SCHEMBL883106

SCHEMBL883106

COC(=O)c1ccc(C(=N)Cl)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.49
NR4A2 P43354 5/20 0.47
CREBBP Q92793 1/20 0.47
LMNA P02545 3/20 0.47
TSHR P16473 1/20 0.47
KDM4E B2RXH2 6/20 0.46
PLK1 P53350 1/20 0.46
ALDH1A1 P00352 3/20 0.46
CFTR P13569 1/20 0.46
HSD17B10 Q99714 1/20 0.46
POLB P06746 1/20 0.44
ATM Q13315 1/20 0.44
GAA P10253 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HPGD P15428 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SLC6A3 Q01959 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL29434198 0.87 BRD4 (0.59) BRD4NR4A2CREBBPLMNATSHR
SCHEMBL70381 0.87 BRD4 (0.59) BRD4NR4A2CREBBPLMNATSHR
SCHEMBL7326322 0.85 BRD4 (0.51) BRD4NR4A2CREBBPLMNATSHR
SCHEMBL5751153 0.80 KMT2A (0.59) BRD4NR4A2CREBBPLMNATSHR
SCHEMBL24101354 0.80 PLK1 (0.70) BRD4NR4A2CREBBPLMNATSHR
SCHEMBL31049726 0.79 BRD4 (0.53) BRD4NR4A2CREBBPLMNATSHR
SCHEMBL982076 0.79 BRD4 (0.53) BRD4NR4A2CREBBPLMNATSHR
SCHEMBL5750893 0.79 BRD4 (0.53) BRD4NR4A2CREBBPLMNATSHR
SCHEMBL31049722 0.79 BRD4 (0.53) BRD4NR4A2CREBBPLMNATSHR
SCHEMBL3116848 0.79 BRD4 (0.46) BRD4NR4A2CREBBPLMNATSHR

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-8404649-B2 Isoxazoline oximes as antiparasitic agents AH USA 42 LLC (US) 2013-03-26 US disclosed
US-20120077765-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS PFIZER INC. (US) 2012-03-29 US disclosed
WO-2012038851-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS PFIZER INC. (US) 2012-03-29 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-20120077765-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS CYP1A2, CYP3A7, CYP2E1 BRD4 2249/4885NR4A2 619/4885CREBBP 4172/4885

“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.