SCHEMBL5934345

SCHEMBL5934345

CCCc1ccc(NC(=O)c2ccc(-c3ccccc3)nc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.59
▸ PTPN2 P17706 1/20 0.59
▸ BAZ2B Q9UIF8 1/20 0.58
▸ NPC1 O15118 2/20 0.57
▸ RAB9A P51151 2/20 0.57
▸ TP53 P04637 1/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57
▸ HPGDS O60760 1/20 0.56
▸ TRPV1 Q8NER1 4/20 0.56
▸ P4HTM Q9NXG6 1/20 0.54
▸ MCHR1 Q99705 2/20 0.53
▸ PTPN6 P29350 1/20 0.51
▸ PTPN11 Q06124 1/20 0.51
▸ LDHA P00338 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ DGAT1 O75907 1/20 0.49
▸ ABCG2 Q9UNQ0 1/20 0.49
▸ NR1H4 Q96RI1 1/20 0.49

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
SCHEMBL5934141 0.87 HPGDS (0.54) PTPN1NPC1HPGDSTRPV1PTPN6
SCHEMBL5934458 0.85 ABCG2 (0.53) NPC1RAB9ATP53SMN1; SMN2HPGDS
SCHEMBL5934158 0.85 TRPV1 (0.52) NPC1RAB9ASMN1; SMN2TRPV1P4HTM
SCHEMBL1543044 0.84 PTPN1 (0.70) PTPN1PTPN2BAZ2BNPC1RAB9A
SCHEMBL5934221 0.84 TRPV1 (0.51) NPC1RAB9ATRPV1P4HTMABCG2
SCHEMBL5934149 0.84 TRPV1 (0.51) NPC1RAB9ASMN1; SMN2TRPV1P4HTM
SCHEMBL5934144 0.83 TRPV1 (0.50) NPC1RAB9ASMN1; SMN2TRPV1P4HTM
SCHEMBL5934195 0.82 TRPV1 (0.52) NPC1RAB9ATRPV1P4HTMALDH1A1
SCHEMBL12136753 0.82 SMN1; SMN2 (0.63) PTPN1PTPN2NPC1RAB9ATP53
SCHEMBL16496203 0.81 PTPN1 (0.77) PTPN1PTPN2BAZ2BNPC1RAB9A

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-20060100245-A1 Substituted biphenyl-4-carboxylic acid arylamide analogues NEUROGEN CORPORATION (US) 2006-05-11 — — 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-20060100245-A1 Substituted biphenyl-4-carboxylic acid arylamide analogues HCAR2, AHR, HCAR3 PTPN1 2912/4885PTPN2 2456/4885BAZ2B 1168/4885

“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.

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