SCHEMBL6073464

SCHEMBL6073464

CC(C)Oc1ccc2c(c1)N(C)C(=O)C2(C)C

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.45
BRPF1 P55201 1/20 0.45
BACE1 P56817 2/20 0.39
POLB P06746 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
CREBBP Q92793 1/20 0.37
TP53 P04637 2/20 0.36
PARP10 Q53GL7 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRK1 P41145 1/20 0.36
OPRL1 P41146 1/20 0.36
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CTSD P07339 1/20 0.35
ALOX15 P16050 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
SCHEMBL9207706 0.84 MEN1 (0.39) BRD4POLBALDH1A1MAPTKMT2A
SCHEMBL3050512 0.83 MEN1 (0.51) POLBALDH1A1MAPTKMT2AMEN1
SCHEMBL9203878 0.82 MEN1 (0.38) BRD4POLBALDH1A1MAPTKMT2A
SCHEMBL6074248 0.79 MEN1 (0.43) BRD4POLBALDH1A1MAPTKMT2A
SCHEMBL19538964 0.76 LMNA (0.41) BRD4POLBKMT2AMEN1CREBBP
SCHEMBL9755257 0.75 CRHBP (0.49) BRD4POLBALDH1A1MAPTKMT2A
SCHEMBL2144650 0.72 MEN1 (0.40) BRD4POLBKMT2AMEN1CREBBP
SCHEMBL19657541 0.72 CASP3 (0.42) BRD4POLBKMT2AMEN1CREBBP
SCHEMBL13650312 0.72 MEN1 (0.40) BRD4POLBMAPTKMT2AMEN1
SCHEMBL1232150 0.72 PDE4A (0.42) BRD4BACE1POLBALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7119207-B2 Benzoamide piperidine containing compounds and related compounds PFIZER INC (US) 2006-10-10 US disclosed
US-20030087925-A1 Benzoamide piperidine containing compounds and related compounds PFIZER INC. 2003-05-08 US disclosed
EP-1272484-A2 BENZOAMIDE PIPERIDINE COMPOUNDS AS SUBSTANCE P ANTAGONISTS Pfizer Products Inc. (US) 2003-01-08 EP disclosed
WO-2001077100-A2 BENZOAMIDE PIPERIDINE COMPOUNDS AS SUBSTANCE P ANTAGONISTS PFIZER PRODUCTS INC. (US) 2001-10-18 WO 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-20030087925-A1 Benzoamide piperidine containing compounds and related compounds TACR1, VIPR1, VIPR2 BRD4 828/4885BRPF1 418/4885BACE1 1320/4885

“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.