SCHEMBL15946010

SCHEMBL15946010

CC/C=C/c1cccc(NS(=O)(=O)C2CCCCC2)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 5/20 0.44
BRPF1 P55201 1/20 0.43
BRD4 O60885 6/20 0.42
MAP2K4 P45985 1/20 0.42
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
XBP1 P17861 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
JAK1 P23458 1/20 0.36
SGK1 O00141 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
KCNT1 Q5JUK3 1/20 0.36
KCNT2 Q6UVM3 1/20 0.36

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
SCHEMBL3122061 0.88 BRD4 (0.42) OPRM1BRPF1BRD4MAP2K4LMNA
SCHEMBL3122069 0.88 BRD4 (0.42) OPRM1BRPF1BRD4MAP2K4LMNA
SCHEMBL3135232 0.79 MAP2K4 (0.39) OPRM1BRPF1BRD4MAP2K4KCNT1
SCHEMBL3135240 0.79 MAP2K4 (0.39) OPRM1BRPF1BRD4MAP2K4KCNT1
SCHEMBL14582136 0.76 SMN1; SMN2 (0.59) OPRM1BRPF1BRD4MAP2K4LMNA
SCHEMBL15576245 0.75 ALDH1A1 (0.43) PRMT6
SCHEMBL15576249 0.75 SMN1; SMN2 (0.61) LMNAHTTSMN1; SMN2
SCHEMBL22268528 0.74 EPHX2 (0.51) OPRM1BRPF1BRD4MAP2K4LMNA
SCHEMBL15054308 0.74 HTR6 (0.51) OPRM1BRPF1BRD4MAP2K4LMNA
SCHEMBL15946017 0.73 OPRM1 (0.45) OPRM1BRPF1BRD4MAP2K4SMN1; SMN2

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-20160145198-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA INC. 2016-05-26 US disclosed
US-9193669-B2 Compounds for treating ophthalmic diseases and disorders ACUCELA INC. (US) 2015-11-24 US disclosed
US-20140228443-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA INC. (US) 2014-08-14 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 (2 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-20160145198-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS PDE6D, CLN6, ALDH1A2 OPRM1 4519/4885BRPF1 3793/4885BRD4 2332/4885
US-20140228443-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS PDE6D, CLN6, ALDH1A2 OPRM1 4519/4885BRPF1 3793/4885BRD4 2332/4885

“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.