SCHEMBL482403

SCHEMBL482403

CC(=O)N1c2ccc3oc(=O)cc(Cc4ccccc4)c3c2[C@H](N)C[C@@H]1C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 14/20 0.41
BRD2 P25440 8/20 0.39
BRD3 Q15059 8/20 0.39
HSD17B3 P37058 1/20 0.39
NOTUM Q6P988 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
AADAT Q8N5Z0 1/20 0.35

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
SCHEMBL482835 0.86 SMN1; SMN2 (0.38) BRD4BRD2BRD3HSD17B3
SCHEMBL10270644 0.65 NOTUM (0.55) BRD4BRD2BRD3NOTUM
SCHEMBL1906140 0.65 BRD4 (0.67) BRD4BRD2BRD3CYP3A4CYP2D6
SCHEMBL11978841 0.65 BRD4 (0.67) BRD4BRD2BRD3CYP3A4CYP2D6
SCHEMBL16061332 0.65 BRD4 (0.58) BRD4BRD2BRD3CYP3A4CYP2D6
SCHEMBL5835887 0.65 BRD4 (0.53) BRD4BRD2BRD3NOTUM
SCHEMBL5835884 0.65 BRD4 (0.53) BRD4BRD2BRD3NOTUM
SCHEMBL5835879 0.65 BRD4 (0.53) BRD4BRD2BRD3NOTUM
SCHEMBL1904035 0.64 BRD4 (0.60) BRD4BRD2BRD3CYP3A4CYP2D6
SCHEMBL223695 0.63 BRD4 (0.63) BRD4BRD2BRD3CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8604030-B2 Fused piperidine compound and pharmaceutical containing same KOWA COMPANY, LTD. (JP) 2013-12-10 US disclosed
US-20120108581-A1 FUSED PIPERIDINE COMPOUND AND PHARMACEUTICAL CONTAINING SAME KOWA COMPANY, LTD (JP) 2012-05-03 US disclosed
EP-2412710-A1 FUSED PIPERIDINE COMPOUND AND PHARMACEUTICAL AGENT COMPRISING SAME Kowa Company, Ltd. (JP) 2012-02-01 EP 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-20120108581-A1 FUSED PIPERIDINE COMPOUND AND PHARMACEUTICAL CONTAINING SAME EPOR, JAK2, HBZ BRD4 1271/4885BRD2 1467/4885BRD3 2032/4885

“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.