SCHEMBL6093689

SCHEMBL6093689

O=C(COc1ccccc1)Nc1ccc2nc(-c3nccs3)[nH]c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.59
SMN1; SMN2 Q16637 7/20 0.59
RAB9A P51151 7/20 0.59
KDM4E B2RXH2 6/20 0.59
NPC1 O15118 6/20 0.59
ALDH1A1 P00352 5/20 0.59
LMNA P02545 4/20 0.59
HPGD P15428 4/20 0.59
MEN1 O00255 3/20 0.59
POLB P06746 3/20 0.59
KMT2A Q03164 3/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
GLA P06280 1/20 0.59
GAA P10253 1/20 0.59
HTT P42858 1/20 0.59
TP53 P04637 6/20 0.52
THRB P10828 1/20 0.52
ALOX12 P18054 1/20 0.52
NPSR1 Q6W5P4 1/20 0.51
FAAH O00519 1/20 0.50

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
SCHEMBL4368880 0.84 MMP2 (0.60) MAPTSMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL6092686 0.84 MAPT (0.51) MAPTSMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL6092352 0.82 SMN1; SMN2 (0.53) MAPTSMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL4371759 0.80 MAPT (0.59) MAPTSMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL6093781 0.80 MAPT (0.53) MAPTSMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL4371270 0.80 NR2E3 (0.59) MAPTSMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL6092024 0.79 SMN1; SMN2 (0.51) MAPTSMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL4372123 0.79 ALDH1A1 (0.49) MAPTSMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL4372536 0.78 MAPT (0.50) MAPTSMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL6090851 0.78 MAPT (0.50) MAPTSMN1; SMN2RAB9AKDM4ENPC1

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 MAPT 2814/4885SMN1; SMN2 2413/4885RAB9A 4310/4885

“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.