SCHEMBL15023717

SCHEMBL15023717

COc1cccc2ccc(C=Cc3ccc4ccc5cccnc5c4n3)nc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 2/20 0.66
▸ KMT2A Q03164 13/20 0.56
▸ MAPT P10636 3/20 0.56
▸ KDM4E B2RXH2 3/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ GLA P06280 1/20 0.56
▸ HPGD P15428 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ MEN1 O00255 11/20 0.54
▸ NPC1 O15118 8/20 0.54
▸ RAB9A P51151 6/20 0.54
▸ ECE2 P0DPD6 1/20 0.53
▸ AGTR1 P30556 3/20 0.52
▸ MCHR1 Q99705 1/20 0.50
▸ POLB P06746 1/20 0.49
▸ OPRK1 P41145 1/20 0.49
▸ LMNA P02545 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ ATM Q13315 2/20 0.47
▸ GMNN O75496 1/20 0.47

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
SCHEMBL15023715 1.00 PDE10A (0.66) PDE10AKMT2AMAPTKDM4EALDH1A1
SCHEMBL17899331 0.84 CCR1 (0.67) PDE10AKMT2AMAPTKDM4EALDH1A1
SCHEMBL19076212 0.82 KMT2A (0.53) PDE10AKMT2AMAPTKDM4EALDH1A1
SCHEMBL19076263 0.81 KMT2A (0.65) KMT2AMAPTKDM4EALDH1A1GLA
SCHEMBL27470619 0.81 KMT2A (0.68) KMT2AMAPTKDM4EALDH1A1GLA
SCHEMBL19076207 0.81 KMT2A (0.68) KMT2AMAPTKDM4EALDH1A1GLA
SCHEMBL170428 0.81 MEN1 (0.68) PDE10AKMT2AMAPTKDM4EALDH1A1
SCHEMBL30614510 0.81 MEN1 (0.68) PDE10AKMT2AMAPTKDM4EALDH1A1
SCHEMBL7509842 0.79 PDE10A (1.00) PDE10AKMT2AMAPTKDM4EALDH1A1
Hydrochloric Acid SCHEMBL6418353 0.79 MEN1 (0.66) PDE10AKMT2AMAPTKDM4EALDH1A1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3318561-B1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2021-12-22 — — EP disclosed
US-10562916-B2 Substituted quinoxalines as PDE-10 inhibitors SUNOVION PHARMACEUTICALS, INC. (US) 2020-02-18 — — US disclosed
EP-2576540-B1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2019-09-04 — — EP disclosed
EP-3318561-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF Sunovion Pharmaceuticals Inc. (US) 2018-05-09 — — EP disclosed
US-20180037590-A1 SUBSTITUTED QUINOLINES AS PDE-10 INHIBITORS SUNOVION PHARMACEUTICALS INC. 2018-02-08 — — US disclosed
US-9834564-B2 Substituted quinolines as PDE-10 inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2017-12-05 — — US disclosed
CN-103038229-B Heteroaryl compounds and methods of use thereof SUNOVION PHARMACEUTICALS INC. (US) 2016-05-11 — — CN disclosed
US-20150166571-A1 Heteroaryl Compounds and Methods of Use Thereof SUNOVION PHARMACEUTICALS INC. 2015-06-18 — — US disclosed
US-8969349-B2 Substituted quinoxalines and quinoxalinones as PDE-10 inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2015-03-03 — — US disclosed
US-20130158003-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2013-06-20 — — US 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 (4 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-20180037590-A1 SUBSTITUTED QUINOLINES AS PDE-10 INHIBITORS PDE10A, PDE2A, PDE3A PDE10A 1/4885KMT2A 273/4885MAPT 2222/4885
US-20130158003-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF COMT, GPR119, NLN PDE10A 2086/4885KMT2A 262/4885MAPT 778/4885
US-10562916-B2 Substituted quinoxalines as PDE-10 inhibitors PDE4A, PDE2A, PDE9A PDE10A 6/4885KMT2A 1967/4885MAPT 2899/4885
US-20150166571-A1 Heteroaryl Compounds and Methods of Use Thereof COMT, GPR119, NLN PDE10A 2086/4885KMT2A 262/4885MAPT 778/4885

“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.

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