SCHEMBL6097904

SCHEMBL6097904

CC(=O)Nc1ccccc1Cc1ccc(N)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.55
ALDH1A1 P00352 3/20 0.50
HPGD P15428 1/20 0.50
MAPK1 P28482 1/20 0.44
BRD4 O60885 1/20 0.43
TSHR P16473 2/20 0.43
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 3/20 0.42
KDM4E B2RXH2 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 1/20 0.42
POLB P06746 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL7522410 0.87 L3MBTL1 (0.71) L3MBTL1ALDH1A1HPGDMAPK1BRD4
SCHEMBL6096285 0.86 L3MBTL1 (0.56) L3MBTL1ALDH1A1HPGDMAPK1BRD4
SCHEMBL9167530 0.86 L3MBTL1 (0.56) L3MBTL1ALDH1A1HPGDMAPK1BRD4
SCHEMBL7680582 0.82 L3MBTL1 (0.49) L3MBTL1ALDH1A1HPGDBRD4TSHR
SCHEMBL28220176 0.82 ALDH1A1 (0.58) L3MBTL1ALDH1A1HPGDTSHRHTT
SCHEMBL7484877 0.81 TSHR (0.58) L3MBTL1ALDH1A1HPGDMAPK1BRD4
SCHEMBL6097282 0.80 CYP19A1 (0.51) L3MBTL1ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL2980662 0.79 HIF1A (0.44) L3MBTL1ALDH1A1HPGDMAPK1TSHR
SCHEMBL17791491 0.79 TSHR (0.50) L3MBTL1ALDH1A1HPGDMAPK1BRD4
SCHEMBL11766148 0.77 ALDH1A1 (0.52) ALDH1A1HPGDMAPK1BRD4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115745-B2 Benzyl urea and thiourea derivatives WARNER LAMBERT COMPANY LLC (US) 2006-10-03 US disclosed
US-20050107427-A1 Benzyl urea and thiourea derivatives DU DANIEL Y (US) 2005-05-19 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-20050107427-A1 Benzyl urea and thiourea derivatives BRDT, TAS2R8, FSHR L3MBTL1 4027/4885ALDH1A1 1968/4885HPGD 2063/4885

“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.