SCHEMBL259311

SCHEMBL259311

Cc1cccc(NC(=O)c2cn[nH]c2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.65
KMT2A Q03164 5/20 0.65
RXFP1 Q9HBX9 1/20 0.65
SMN1; SMN2 Q16637 3/20 0.62
ALDH1A1 P00352 2/20 0.62
LMNA P02545 1/20 0.62
KCNK3 O14649 8/20 0.60
KCNK9 Q9NPC2 7/20 0.60
KCNH2 Q12809 1/20 0.60
RAB9A P51151 2/20 0.59
NPC1 O15118 1/20 0.59
TP53 P04637 1/20 0.59
NFKB1 P19838 1/20 0.59
NFKB2 Q00653 1/20 0.59
RELA Q04206 1/20 0.59
POLB P06746 1/20 0.56
NTRK1 P04629 1/20 0.54
ALOX5 P09917 1/20 0.53
HTT P42858 1/20 0.53
HSD17B10 Q99714 1/20 0.53

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
SCHEMBL21348467 0.82 CHRNB4 (0.53) SMN1; SMN2ALDH1A1LMNARAB9ANPC1
SCHEMBL21695760 0.82 FADS1 (0.53) RXFP1SMN1; SMN2RAB9ANPC1NTRK1
SCHEMBL28304288 0.81 RAB9A (0.62) SMN1; SMN2LMNARAB9ANPC1TP53
SCHEMBL601922 0.81 ROCK1 (0.59) SMN1; SMN2ALDH1A1KCNK3KCNK9RAB9A
SCHEMBL2908619 0.81 MEN1 (0.89) MEN1KMT2ARXFP1SMN1; SMN2ALDH1A1
SCHEMBL21349104 0.80 KMT2A (0.67) MEN1KMT2ARXFP1SMN1; SMN2ALDH1A1
SCHEMBL4253897 0.79 KCNK3 (0.93) MEN1KMT2ARXFP1KCNK3KCNK9
SCHEMBL259706 0.78 MEN1 (0.77) MEN1KMT2ARXFP1SMN1; SMN2ALDH1A1
SCHEMBL259468 0.78 KCNK3 (0.87) MEN1KMT2ARXFP1SMN1; SMN2ALDH1A1
SCHEMBL29434800 0.78 KCNK3 (0.87) MEN1KMT2ARXFP1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 MEN1 3330/4885KMT2A 1722/4885RXFP1 4866/4885
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 MEN1 3494/4885KMT2A 1854/4885RXFP1 434/4885
US-20070037805-A1 Fused heteroaryl derivatives PIK3CD, PIK3R3, PIK3C2A MEN1 3330/4885KMT2A 1722/4885RXFP1 4866/4885
US-20100137585-A1 FUSED HETEROARYL DERIVATIVES PIK3CD, PIK3R3, PIK3C2A MEN1 3330/4885KMT2A 1722/4885RXFP1 4866/4885
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 MEN1 3494/4885KMT2A 1854/4885RXFP1 434/4885

“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.