SCHEMBL3533928

SCHEMBL3533928

COc1cc2[nH]nc(-c3nc4ccccc4n3C)c2cc1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
LMNA P02545 3/20 0.43
GAA P10253 3/20 0.43
HTT P42858 2/20 0.43
POLB P06746 2/20 0.43
TP53 P04637 4/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
RPS6KB1 P23443 1/20 0.42
GSK3B P49841 1/20 0.42
KDR P35968 4/20 0.42
PLK1 P53350 1/20 0.42
PTK2 Q05397 1/20 0.42
AURKB Q96GD4 1/20 0.42
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 2/20 0.42

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
SCHEMBL3540087 0.90 ABL1 (0.49) RAB9A
SCHEMBL3535832 0.84 ABL1 (0.45) MEN1KMT2ASMN1; SMN2LMNAGAA
SCHEMBL3538583 0.83 ABL1 (0.47) ADORA1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3541944 0.82 KDM4E (0.46) MEN1KMT2ASMN1; SMN2LMNAGAA
SCHEMBL3590449 0.82 CACNA1D (0.41) SMN1; SMN2POLBRAB9AKDM4EMAPK1
SCHEMBL3532370 0.81 HTT (0.47) MEN1KMT2ASMN1; SMN2LMNAGAA
SCHEMBL3541251 0.81 RAB9A (0.45) ADORA1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3540321 0.79 MAP2K4 (0.55) MEN1KMT2ASMN1; SMN2LMNAGAA
SCHEMBL3539742 0.79 SMN1; SMN2 (0.44) MEN1KMT2ASMN1; SMN2LMNAGAA
SCHEMBL3535791 0.79 TP53 (0.47) MEN1KMT2ASMN1; SMN2GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7642278-B2 Nitrogen compounds such as 3-(5-morpholin-4-yl-1H-benz-imidazol-2-yl)-1H-indazole and/or isomers, used as immunology modulators, antidiabetic agents, antiogenesis inhibitors or for prophylaxis of Alzheimer's disease NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-01-05 US disclosed
US-7642278-B2 Nitrogen compounds such as 3-(5-morpholin-4-yl-1H-benz-imidazol-2-yl)-1H-indazole and/or isomers, used as immunology modulators, antidiabetic agents, antiogenesis inhibitors or for prophylaxis of Alzheimer's disease NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-01-05 US disclosed
US-7642278-B2 Nitrogen compounds such as 3-(5-morpholin-4-yl-1H-benz-imidazol-2-yl)-1H-indazole and/or isomers, used as immunology modulators, antidiabetic agents, antiogenesis inhibitors or for prophylaxis of Alzheimer's disease NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-01-05 US disclosed
US-20060079564-A1 Indazole benzimidazole compounds CHIRON CORPORATION 2006-04-13 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 (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-20060079564-A1 Indazole benzimidazole compounds ABL1, ABL2, ALK ADORA1 4492/4885MEN1 1771/4885KMT2A 1429/4885

“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.