SCHEMBL6092669

SCHEMBL6092669

O=C(Cc1cc(F)c(F)c(F)c1)Nc1ccc2c(c1)ncn2-c1nccs1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.44
RAB9A P51151 10/20 0.44
SMN1; SMN2 Q16637 9/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
HPGD P15428 2/20 0.42
ADRA2B P18089 3/20 0.40
NR1I2 O75469 2/20 0.40
POLB P06746 1/20 0.40
TP53 P04637 2/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SCN3A Q9NY46 1/20 0.38

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
SCHEMBL4365495 0.91 NPC1 (0.45) NPC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL4368858 0.83 MEN1 (0.50) NPC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL6092966 0.76 SMN1; SMN2 (0.45) SMN1; SMN2LMNAKMT2AMEN1POLB
SCHEMBL6092660 0.72 SMN1; SMN2 (0.43) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL4367689 0.72 HPGD (0.49) NPC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL4372973 0.71 NPC1 (0.50) NPC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL6094816 0.70 LMNA (0.54) NPC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL6091957 0.70 LMNA (0.54) NPC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL6092695 0.69 PDE10A (0.44) NPC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL4363669 0.69 FFAR2 (0.56) NPC1RAB9ASMN1; SMN2LMNAKMT2A

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 NPC1 3580/4885RAB9A 4310/4885SMN1; SMN2 2413/4885

“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.