SCHEMBL318427

SCHEMBL318427

O=c1sc2ccccc2n1CCCCl

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.68
▸ CYP3A4 P08684 3/20 0.68
▸ CYP2D6 P10635 3/20 0.68
▸ CYP2C19 P33261 3/20 0.68
▸ NPC1 O15118 3/20 0.68
▸ RAB9A P51151 3/20 0.68
▸ SMN1; SMN2 Q16637 3/20 0.68
▸ CYP1A2 P05177 2/20 0.68
▸ CYP2C9 P11712 2/20 0.68
▸ SIGMAR1 Q99720 1/20 0.62
▸ TSHR P16473 2/20 0.62
▸ ATM Q13315 1/20 0.62
▸ HPGD P15428 1/20 0.62
▸ TDP1 Q9NUW8 1/20 0.62
▸ ALDH1A1 P00352 1/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ KDM4E B2RXH2 1/20 0.61
▸ PKM P14618 1/20 0.61

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2148992 0.95 CYP3A4 (0.67) L3MBTL1CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL2149958 0.94 NPC1 (0.65) L3MBTL1CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL2149611 0.94 NPC1 (0.65) L3MBTL1CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL2149244 0.90 L3MBTL1 (0.65) L3MBTL1CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL4617266 0.83 CYP3A4 (0.64) L3MBTL1CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL4057219 0.83 L3MBTL1 (0.64) L3MBTL1CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL318582 0.83 L3MBTL1 (0.64) L3MBTL1CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL4230610 0.83 L3MBTL1 (0.65) L3MBTL1CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL4846941 0.82 L3MBTL1 (0.69) L3MBTL1NPC1RAB9ASMN1; SMN2TSHR
SCHEMBL6419192 0.82 CYP3A4 (0.62) L3MBTL1CYP3A4CYP2D6CYP2C19NPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3138841-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2017-03-08 — — EP disclosed
US-9156840-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2015-10-13 — — US disclosed
US-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-27 — — US disclosed
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC 2012-01-12 — — US disclosed
EP-1432420-B1 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS ACADIA PHARM INC (US) 2011-07-13 — — EP disclosed
US-20100216840-A1 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS ACADIA PHARMACEUTICALS INC. (US) 2010-08-26 — — US disclosed
US-20080070948-A1 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS ACADIA PHARMACEUTICALS INC. (US) 2008-03-20 — — US disclosed
US-20080009520-A1 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS ACADIA PHARMACEUTICALS INC. (US) 2008-01-10 — — US disclosed
US-7300928-B2 Benzimidazolidinone derivatives as muscarinic agents ACADIA PHARMACEUTICALS, INC. (US) 2007-11-27 — — US disclosed
US-7291611-B2 Benzimidazolidinone derivatives as muscarinic agents ACADIA PHARMACEUTICALS INC. (US) 2007-11-06 — — US disclosed
US-20060199799-A1 Benzimidazolidinone derivatives as muscarinic agents KELLY NICHOLAS M 2006-09-07 — — US disclosed
US-7087593-B2 Benzimidazolidinone derivatives as muscarinic agents ACADIA PHARMACEUTICALS INC. (US) 2006-08-08 — — US disclosed
US-20060025402-A1 Benzimidazolidinone derivatives as muscarinic agents KELLY NICHOLAS M 2006-02-02 — — US disclosed
EP-1432420-A4 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS ACADIA PHARM INC (US) 2005-11-09 — — EP disclosed
US-6951849-B2 Benzimidazolidinone derivatives as muscarinic agents ACADIA PHARMACEUTICALS INC. (US) 2005-10-04 — — US disclosed
WO-2004089942-A2 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS ACADIA PHARMACEUTICALS INC. (US) 2004-10-21 — — WO disclosed
EP-1432420-A2 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS Acadia Pharmaceuticals Inc. (US) 2004-06-30 — — EP disclosed
US-20040067931-A1 Benzimidazolidinone derivatives as muscarinic agents ACADIA PHARMACEUTICALS INC. 2004-04-08 — — US disclosed
US-20030100545-A1 Benzimidazolidinone derivatives as muscarinic agents ACADIA PHARMACEUTICALS, INC. 2003-05-29 — — US disclosed
WO-2003028650-A2 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS ACADIA PHARMACEUTICALS, INC. (US) 2003-04-10 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080070948-A1 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS CHRM4, CHRM1, CHRM2 L3MBTL1 2378/4885CYP3A4 735/4885CYP2D6 2195/4885
US-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 L3MBTL1 2998/4885CYP3A4 659/4885CYP2D6 250/4885
US-20030100545-A1 Benzimidazolidinone derivatives as muscarinic agents CHRM4, CHRM5, CHRM1 L3MBTL1 2315/4885CYP3A4 967/4885CYP2D6 2683/4885
US-20100216840-A1 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS CHRM4, CHRM1, CHRM2 L3MBTL1 2378/4885CYP3A4 735/4885CYP2D6 2195/4885
US-20060025402-A1 Benzimidazolidinone derivatives as muscarinic agents CHRM4, CHRM1, CHRM2 L3MBTL1 2378/4885CYP3A4 735/4885CYP2D6 2195/4885
US-20080009520-A1 BENZIMIDAZOLIDINONE DERIVATIVES AS MUSCARINIC AGENTS CHRM4, CHRM1, CHRM2 L3MBTL1 2378/4885CYP3A4 735/4885CYP2D6 2195/4885
US-20040067931-A1 Benzimidazolidinone derivatives as muscarinic agents CHRM4, CHRM5, CHRM1 L3MBTL1 2315/4885CYP3A4 967/4885CYP2D6 2683/4885
US-20060199799-A1 Benzimidazolidinone derivatives as muscarinic agents CHRM4, CHRM1, CHRM2 L3MBTL1 2378/4885CYP3A4 735/4885CYP2D6 2195/4885
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 L3MBTL1 2998/4885CYP3A4 659/4885CYP2D6 250/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback