SCHEMBL7800461

SCHEMBL7800461

CC1(C)CC=C(OS(=O)(=O)C(F)(F)F)c2cc(C#Cc3ccc(C(=O)O)cc3)ccc21

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARB P10826 19/20 0.61
RARG P13631 19/20 0.61
RARA P10276 18/20 0.61
CYP26A1 O43174 1/20 0.49
CYP3A4 P08684 1/20 0.49
CRABP2 P29373 1/20 0.49

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
SCHEMBL6239862 0.89 RARA (0.49) RARBRARGRARACYP26A1CYP3A4
SCHEMBL8664382 0.88 RARB (0.44) RARBRARGRARA
SCHEMBL8682491 0.88 RARA (0.46) RARBRARGRARA
SCHEMBL8682496 0.88 RARA (0.46) RARBRARGRARA
SCHEMBL6818882 0.84 RARB (0.48) RARBRARGRARACYP26A1
SCHEMBL6238701 0.84 RARA (0.60) RARBRARGRARA
SCHEMBL6238706 0.84 RARA (0.60) RARBRARGRARA
SCHEMBL8981637 0.82 RARA (0.60) RARBRARGRARACYP26A1CYP3A4
SCHEMBL8901460 0.82 RARB (0.67) RARBRARGRARACYP26A1CYP3A4
SCHEMBL8901255 0.81 RARB (0.63) RARBRARGRARACYP26A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6319948-B2 PREVENTION AND/OR MINIMIZATION OF SURGICAL ADHESION FORMATION BY ADMINISTERING CERTAIN SUBSTITUTED (5,6)-DIHYDRONAPHTHALENYL COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2001-11-20 US disclosed
US-20010003780-A1 Retinoid antagonists and uses thereof TRAMPOSCH KENNETH M (US) 2001-06-14 US disclosed
WO-1998046228-A1 RETINOID ANTAGONISTS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY (US) 1998-10-22 WO disclosed
EP-0853610-A2 SYNTHESIS AND USE OF RETINOID COMPOUNDS HAVING NEGATIVE HORMONE AND/OR ANTAGONIST ACTIVITIES Allergan (US) 1998-07-22 EP disclosed
WO-1997009297-A2 SYNTHESIS AND USE OF RETINOID COMPOUNDS HAVING NEGATIVE HORMONE AND/OR ANTAGONIST ACTIVITIES VISION PHARMACEUTICALS L.P. (US) 1997-03-13 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-20010003780-A1 Retinoid antagonists and uses thereof RARA, RARB, RARG RARB 2/4885RARG 3/4885RARA 1/4885

“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.