SCHEMBL2348486

SCHEMBL2348486

CCOC(=O)c1c(S(=O)(=O)NCCNC(=O)c2ccc(OC)cc2)c2cc(Br)ccc2n1S(=O)(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.43
OPRK1 P41145 5/20 0.40
OPRM1 P35372 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MTNR1B P49286 1/20 0.40
ELANE P08246 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PTGDR Q13258 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
PTGS2 P35354 1/20 0.38
HTT P42858 1/20 0.38
HTR6 P50406 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
SCHEMBL2349950 0.90 KMT2A (0.40) SMN1; SMN2MTNR1BELANEPTGDRPTGDR2
SCHEMBL2345719 0.90 PTGDR (0.41) SMN1; SMN2MTNR1BELANEPTGDRPTGDR2
SCHEMBL2351720 0.89 HTR6 (0.42) SMN1; SMN2MTNR1BELANEPTGDRPTGDR2
SCHEMBL2346554 0.86 SMN1; SMN2 (0.44) USP2SMN1; SMN2ELANEPTGDRPTGDR2
SCHEMBL2344548 0.86 HTR6 (0.39) SMN1; SMN2MTNR1BELANEPTGDRPTGDR2
SCHEMBL2345691 0.86 HTR6 (0.39) SMN1; SMN2ELANEPTGDRPTGDR2HTT
SCHEMBL2350038 0.84 ELANE (0.43) SMN1; SMN2ELANEPTGDRPTGDR2
SCHEMBL2342085 0.84 ELANE (0.40) MTNR1BELANEPTGDRPTGDR2HTR6
Hydrochloric Acid SCHEMBL2349568 0.84 ELANE (0.43) SMN1; SMN2MTNR1BELANEPTGDRPTGDR2
SCHEMBL2351658 0.83 ALDH1A1 (0.43) SMN1; SMN2MTNR1BELANEPTGDRPTGDR2

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-8008295-B2 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2011-08-30 US disclosed
US-20100041652-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2010-02-18 US disclosed
US-20080008708-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2008-01-10 US disclosed
US-20060128783-A1 Tyrosine kinase inhibitors DINSMORE CHRISTOPHER J 2006-06-15 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 (3 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-20060128783-A1 Tyrosine kinase inhibitors ABL1, ERBB2, JAK2 USP2 2182/4885OPRK1 952/4885OPRM1 2271/4885
US-20080008708-A1 Tyrosine kinase inhibitors ABL1, ERBB2, JAK2 USP2 2182/4885OPRK1 952/4885OPRM1 2271/4885
US-20100041652-A1 TYROSINE KINASE INHIBITORS ABL1, ERBB2, JAK2 USP2 2182/4885OPRK1 952/4885OPRM1 2271/4885

“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.