SCHEMBL1995023

SCHEMBL1995023

Cc1ccc2nc(-c3ccc(NC(=O)c4ccc(N(C)C)nc4)cc3)cn2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.60
SMN1; SMN2 Q16637 7/20 0.60
NPC1 O15118 7/20 0.60
KDM4E B2RXH2 6/20 0.60
ALDH1A1 P00352 6/20 0.60
HPGD P15428 4/20 0.60
APP P05067 2/20 0.51
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP2C19 P33261 1/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PAX8 Q06710 2/20 0.48
MITF O75030 1/20 0.48
KDM5A P29375 1/20 0.48
KDM5C P41229 1/20 0.48
MAPT P10636 4/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 3/20 0.46
MCHR1 Q99705 4/20 0.46

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
SCHEMBL12422138 0.86 SMN1; SMN2 (0.64) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1
SCHEMBL2195616 0.86 SMN1; SMN2 (0.64) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1
SCHEMBL2193327 0.85 RAB9A (0.65) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1
SCHEMBL2197255 0.85 APP (0.69) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1
SCHEMBL16623339 0.85 NPC1 (0.74) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1
SCHEMBL1999354 0.84 SMN1; SMN2 (0.61) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1
SCHEMBL2194003 0.82 SMN1; SMN2 (0.60) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1
SCHEMBL2194816 0.82 NPC1 (0.70) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1
SCHEMBL2194530 0.82 NPC1 (0.70) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1
SCHEMBL2193852 0.81 NPC1 (0.68) RAB9ASMN1; SMN2NPC1KDM4EALDH1A1

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-2338059-B1 Ligands for aggregated tau molecules WISTA LAB LTD (SG) 2015-04-08 EP disclosed
US-8895313-B2 Ligands for aggregated tau molecules WISTA LABORATORIES LTD. (SG) 2014-11-25 US disclosed
US-8895313-B2 Ligands for aggregated tau molecules WISTA LABORATORIES LTD. (SG) 2014-11-25 US disclosed
US-8895313-B2 Ligands for aggregated tau molecules WISTA LABORATORIES LTD. (SG) 2014-11-25 US disclosed
US-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. 2011-07-14 US disclosed
US-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. 2011-07-14 US disclosed
US-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. 2011-07-14 US disclosed
EP-2338059-A1 LIGANDS FOR AGGREGATED TAU MOLECULES Wista Laboratories Ltd. (SG) 2011-06-29 EP disclosed
WO-2010034982-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. (SG) 2010-04-01 WO disclosed
WO-2010034982-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. (SG) 2010-04-01 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 (1 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-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES MAPT, PRNP, MAP4 RAB9A 2622/4885SMN1; SMN2 1022/4885NPC1 1265/4885

“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.