SCHEMBL6090866

SCHEMBL6090866

CC(O)(C(=O)Nc1ccc2ncn(-c3nccs3)c2c1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.49
PDE10A Q9Y233 1/20 0.41
KDR P35968 2/20 0.41
AURKA O14965 1/20 0.41
AURKB Q96GD4 1/20 0.41
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
ATM Q13315 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 1/20 0.38
LMNA P02545 1/20 0.38
EIF2S1 P05198 2/20 0.38
EIF2AK3 Q9NZJ5 2/20 0.38
JAK3 P52333 2/20 0.37
JAK2 O60674 1/20 0.37
STK16 O75716 1/20 0.37
FYN P06241 1/20 0.37
SRC P12931 1/20 0.37
FLT1 P17948 1/20 0.37
BTK Q06187 1/20 0.37

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
SCHEMBL4372973 0.83 NPC1 (0.50) KDRAURKAAURKBNPC1RAB9A
SCHEMBL4372131 0.78 ALDH1A1 (0.47) PDE10ASMN1; SMN2MAPTLMNAEIF2S1
SCHEMBL6092695 0.77 PDE10A (0.44) PDE10ANPC1RAB9AATMSMN1; SMN2
SCHEMBL6092359 0.77 ALDH1A1 (0.46) PDE10ANPC1RAB9ASMN1; SMN2MAPT
SCHEMBL6090851 0.72 MAPT (0.50) ARNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4372536 0.72 MAPT (0.50) ARNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4377654 0.72 ANO1 (0.48) PDE10A
SCHEMBL6091957 0.70 LMNA (0.54) NPC1RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL6092966 0.70 SMN1; SMN2 (0.45) SMN1; SMN2MAPTLMNA
SCHEMBL6094816 0.70 LMNA (0.54) NPC1RAB9ASMN1; SMN2MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060036098-A1 Carbonylamino-benzimidazole derivatives as androgen receptor modulators MERCK SHARP & DOHME CORP. 2006-02-16 US claimed

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-20060036098-A1 Carbonylamino-benzimidazole derivatives as androgen receptor modulators AR, SHBG, BRCA1 AR 1/4885PDE10A 2439/4885KDR 2254/4885

“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.