SCHEMBL5934585

SCHEMBL5934585

Cc1ccc(-c2ccc(C(=O)Nc3cccc(C(C)(C)C)c3)cn2)cc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 1/20 0.55
▸ HDAC8 Q9BY41 1/20 0.55
▸ HDAC6 Q9UBN7 1/20 0.55
▸ MAPK14 Q16539 7/20 0.51
▸ EPHA3 P29320 1/20 0.51
▸ FRK P42685 1/20 0.51
▸ RAF1 P04049 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ TP53 P04637 1/20 0.48
▸ THRB P10828 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ KCNK9 Q9NPC2 1/20 0.48
▸ TRPV1 Q8NER1 2/20 0.47
▸ KCNK3 O14649 1/20 0.47
▸ KIT P10721 5/20 0.47
▸ KDR P35968 5/20 0.47
▸ LCK P06239 4/20 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
SCHEMBL5934416 0.89 HDAC3 (0.57) HDAC3HDAC8HDAC6MAPK14EPHA3
SCHEMBL5934657 0.86 HDAC8 (0.54) HDAC3HDAC8HDAC6SMN1; SMN2ALDH1A1
SCHEMBL5934188 0.86 HDAC3 (0.56) HDAC3HDAC8HDAC6SMN1; SMN2ALDH1A1
SCHEMBL5934109 0.85 RAB9A (0.58) SMN1; SMN2TP53ALDH1A1MEN1LMNA
SCHEMBL5934471 0.85 MEN1 (0.57) HDAC3HDAC8HDAC6MAPK14SMN1; SMN2
SCHEMBL5934381 0.85 HPGDS (0.55) HDAC3HDAC8HDAC6SMN1; SMN2ALDH1A1
SCHEMBL5934592 0.85 HDAC3 (0.55) HDAC3HDAC8HDAC6SMN1; SMN2ALDH1A1
SCHEMBL5934509 0.84 RAF1 (0.55) HDAC3HDAC8HDAC6MAPK14EPHA3
SCHEMBL5934224 0.83 TP53 (0.55) HDAC3HDAC8HDAC6SMN1; SMN2TP53
SCHEMBL5934639 0.83 HDAC8 (0.53) HDAC3HDAC8HDAC6SMN1; SMN2ALDH1A1

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 HDAC3 424/4885HDAC8 740/4885HDAC6 1243/4885

“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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