SCHEMBL6092686

SCHEMBL6092686

O=C(CC(c1ccccc1)c1ccccc1)Nc1ccc2nc(-c3nccs3)[nH]c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.51
RAB9A P51151 8/20 0.51
ALDH1A1 P00352 11/20 0.48
KDM4E B2RXH2 10/20 0.48
SMN1; SMN2 Q16637 10/20 0.48
HPGD P15428 8/20 0.48
TP53 P04637 6/20 0.48
NPC1 O15118 6/20 0.48
HSD17B10 Q99714 5/20 0.48
KLK7 P49862 1/20 0.48
KMT2A Q03164 5/20 0.47
POLB P06746 4/20 0.47
APAF1 O14727 1/20 0.47
PPARG P37231 1/20 0.47
RECQL P46063 1/20 0.47
SMAD3 P84022 1/20 0.47
PTK2B Q14289 1/20 0.47
ESR2 Q92731 1/20 0.47
NR2E3 Q9Y5X4 1/20 0.47
NCOR2 Q9Y618 1/20 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
SCHEMBL6092352 0.92 SMN1; SMN2 (0.53) MAPTRAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL6093781 0.86 MAPT (0.53) MAPTRAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL6092024 0.85 SMN1; SMN2 (0.51) MAPTRAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL6093689 0.84 MAPT (0.59) MAPTRAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL4368880 0.84 MMP2 (0.60) MAPTRAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL4372123 0.83 ALDH1A1 (0.49) MAPTRAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL4371250 0.80 METAP1 (0.58) MAPTRAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL4371270 0.80 NR2E3 (0.59) MAPTRAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL6090851 0.78 MAPT (0.50) MAPTRAB9AALDH1A1KDM4ESMN1; SMN2
SCHEMBL4372536 0.78 MAPT (0.50) MAPTRAB9AALDH1A1KDM4ESMN1; SMN2

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 2814/4885RAB9A 4310/4885ALDH1A1 916/4885

“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.