SCHEMBL6501730

SCHEMBL6501730

Cc1ccc(C2=C(C(=O)Nc3ccc(NC(=O)Cc4cccc(N)n4)cc3)CCCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
TP53 P04637 7/20 0.38
P2RY14 Q15391 1/20 0.38
POLB P06746 2/20 0.38
THRB P10828 1/20 0.38
ATR Q13535 1/20 0.38
SMN1; SMN2 Q16637 6/20 0.38
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
NLRP3 Q96P20 1/20 0.38
CYP2D6 P10635 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
CTPS1 P17812 1/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NFKB1 P19838 1/20 0.37

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
SCHEMBL6488407 0.88 LMNA (0.47) P2RY14NLRP3CTPS1KDM4E
SCHEMBL6531977 0.87 TP53 (0.40) TP53POLBTHRBATRSMN1; SMN2
SCHEMBL6491873 0.85 TP53 (0.38) GAATP53P2RY14POLBTHRB
SCHEMBL6679658 0.84 ITGB1 (0.43) TP53POLBTHRBATRSMN1; SMN2
SCHEMBL6492454 0.82 MAPT (0.41) TP53SMN1; SMN2RAB9ANPC1CYP2C9
SCHEMBL6492313 0.82 EIF2AK3 (0.46) GAATP53POLBSMN1; SMN2RAB9A
SCHEMBL6491525 0.80 ALDH1A1 (0.38) TP53POLBTHRBATRSMN1; SMN2
SCHEMBL6498885 0.80 PPARG (0.37) TP53POLBTHRBATRRAB9A
SCHEMBL6499546 0.79 RAB9A (0.39) TP53POLBTHRBSMN1; SMN2RAB9A
SCHEMBL6491821 0.76 CXCR4 (0.41) TP53SMN1; SMN2RAB9ANPC1KDM4E

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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 GAA 2041/4885TP53 3031/4885P2RY14 3028/4885

“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.