SCHEMBL259295

SCHEMBL259295

Cc1cccc(NC(=O)c2c[nH]cn2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.60
MEN1 O00255 5/20 0.60
KMT2A Q03164 5/20 0.60
ALDH1A1 P00352 3/20 0.60
LMNA P02545 1/20 0.60
MAPT P10636 2/20 0.58
KDM4E B2RXH2 1/20 0.58
RXFP1 Q9HBX9 1/20 0.55
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
HSD17B10 Q99714 1/20 0.51
KCNK3 O14649 3/20 0.51
KCNK9 Q9NPC2 2/20 0.51
KCNH2 Q12809 1/20 0.51
SCN2A Q99250 1/20 0.51
SCN10A Q9Y5Y9 1/20 0.51
TSHR P16473 1/20 0.49
FLT3 P36888 1/20 0.49
MAP4K1 Q92918 1/20 0.49
TP53 P04637 1/20 0.49

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
SCHEMBL10821556 0.83 SMN1; SMN2 (0.54) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL21348763 0.82 FADS1 (0.52) SMN1; SMN2MEN1KMT2AALDH1A1RXFP1
SCHEMBL1078326 0.82 RAB9A (0.55) SMN1; SMN2ALDH1A1MAPTKDM4ENPC1
SCHEMBL1079994 0.82 POLB (0.56) SMN1; SMN2KMT2AALDH1A1KDM4ENPC1
SCHEMBL29723905 0.78 KDR (0.72) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL30643208 0.78 KDR (0.72) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL259238 0.78 KDR (0.72) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL22362615 0.78 F2R (0.63) KMT2ARXFP1NPC1RAB9A
SCHEMBL21348779 0.76 SMN1; SMN2 (0.59) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL17279781 0.76 SMN1; SMN2 (0.56) SMN1; SMN2MEN1KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023009475-A1 ROCK2 INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-02-02 WO disclosed
US-10556898-B2 Indazolyl-1,2,4-thiadiazolamines and related compounds for inhibition of Rho-associated protein kinase and the treatment of disease LYCERA CORPORATION (US) 2020-02-11 US disclosed
US-20190276447-A1 INDAZOLYL-1,2,4-THIADIAZOLAMINES AND RELATED COMPOUNDS FOR INHIBITION OF RHO-ASSOCIATED PROTEIN KINASE AND THE TREATMENT OF DISEASE LYCERA CORPORATION 2019-09-12 US disclosed
US-8067586-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2011-11-29 US disclosed
US-8067586-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2011-11-29 US disclosed
US-20100137584-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20100137584-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20100137585-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20100137585-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20070037805-A1 Fused heteroaryl derivatives HAYAKAWA MASAHIKO 2007-02-15 US disclosed
US-20070037805-A1 Fused heteroaryl derivatives HAYAKAWA MASAHIKO 2007-02-15 US disclosed
US-7173029-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2007-02-06 US disclosed
US-7173029-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2007-02-06 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 (5 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-20100137584-A1 FUSED HETEROARYL DERIVATIVES PIK3CD, PIK3R3, PIK3C2A SMN1; SMN2 4764/4885MEN1 3330/4885KMT2A 1722/4885
US-20190276447-A1 INDAZOLYL-1,2,4-THIADIAZOLAMINES AND RELATED COMPOUNDS FOR INHIBITION OF RHO-ASSOCIATED PROTEIN KINASE AND THE TREATMENT OF DISEASE ROCK1, ROCK2, TNK2 SMN1; SMN2 4283/4885MEN1 3494/4885KMT2A 1854/4885
US-20070037805-A1 Fused heteroaryl derivatives PIK3CD, PIK3R3, PIK3C2A SMN1; SMN2 4764/4885MEN1 3330/4885KMT2A 1722/4885
US-20100137585-A1 FUSED HETEROARYL DERIVATIVES PIK3CD, PIK3R3, PIK3C2A SMN1; SMN2 4764/4885MEN1 3330/4885KMT2A 1722/4885
US-10556898-B2 Indazolyl-1,2,4-thiadiazolamines and related compounds for inhibition of Rho-associated protein kinase and the treatment of disease ROCK1, ROCK2, TNK2 SMN1; SMN2 4283/4885MEN1 3494/4885KMT2A 1854/4885

“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.