SCHEMBL5951918

SCHEMBL5951918

CCOc1cc(-c2nc3ccccc3[nH]2)n[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.54
FGFR2 P21802 1/20 0.54
FGFR3 P22607 1/20 0.54
CBFB Q13951 1/20 0.50
SMN1; SMN2 Q16637 10/20 0.49
NPC1 O15118 8/20 0.49
RAB9A P51151 8/20 0.49
HPGD P15428 5/20 0.49
PKM P14618 5/20 0.49
METAP2 P50579 3/20 0.49
LMNA P02545 2/20 0.49
METAP1 P53582 2/20 0.49
MTOR P42345 1/20 0.49
ADORA3 P0DMS8 2/20 0.48
ADORA2A P29274 1/20 0.48
ADORA1 P30542 1/20 0.48
ALDH1A1 P00352 7/20 0.47
KDM4E B2RXH2 6/20 0.47
TP53 P04637 5/20 0.47
HSD17B10 Q99714 4/20 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
SCHEMBL13373477 0.79 HRH3 (0.44) FGFR1FGFR2FGFR3SMN1; SMN2NPC1
SCHEMBL1528347 0.78 NPC1 (0.58) FGFR1FGFR2FGFR3SMN1; SMN2NPC1
SCHEMBL22488748 0.77 SMN1; SMN2 (0.56) FGFR1FGFR2FGFR3SMN1; SMN2NPC1
SCHEMBL25425247 0.77 FOXO1 (0.59) FGFR1FGFR2FGFR3SMN1; SMN2NPC1
SCHEMBL30754028 0.77 FOXO1 (0.59) FGFR1FGFR2FGFR3SMN1; SMN2NPC1
SCHEMBL5952231 0.75 NPC1 (0.58) FGFR1FGFR2FGFR3SMN1; SMN2NPC1
SCHEMBL13373870 0.73 NPC1 (0.51) FGFR1FGFR2FGFR3SMN1; SMN2NPC1
SCHEMBL5951313 0.73 FGFR1 (0.54) FGFR1FGFR2FGFR3SMN1; SMN2NPC1
SCHEMBL2374336 0.73 L3MBTL1 (0.53) NPC1RAB9ALMNAADORA3ADORA2A
SCHEMBL13348557 0.72 BTK (0.54) FGFR1FGFR2FGFR3SMN1; SMN2NPC1

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
US-20060014756-A1 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2006-01-19 US claimed
US-6897208-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2005-05-24 US claimed
EP-1441725-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS Aventis Pharmaceuticals Inc. (US) 2004-08-04 EP claimed
US-20040048868-A1 Benzimidazoles AVENTISUB LLC 2004-03-11 US claimed
WO-2003035065-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS AVENTIS PHARMACEUTICALS INC (US) 2003-05-01 WO claimed
US-8288425-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2012-10-16 US disclosed
US-8288425-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2012-10-16 US disclosed
US-8288425-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2012-10-16 US disclosed
US-20060014756-A1 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2006-01-19 US disclosed
US-6897208-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2005-05-24 US disclosed
EP-1441725-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS Aventis Pharmaceuticals Inc. (US) 2004-08-04 EP disclosed
US-20040048868-A1 Benzimidazoles AVENTISUB LLC 2004-03-11 US disclosed
WO-2003035065-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS AVENTIS PHARMACEUTICALS INC (US) 2003-05-01 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 (2 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-20060014756-A1 Benzimidazoles CDK9, BMX, SBK3 FGFR1 583/4885FGFR2 757/4885FGFR3 532/4885
US-20040048868-A1 Benzimidazoles CDK9, BMX, CDKN1A FGFR1 254/4885FGFR2 600/4885FGFR3 464/4885

“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.