SCHEMBL19253583

SCHEMBL19253583

CCCCCc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(F)c(Cl)c5)c(Cl)c4)cc3F)cc2F)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.54
RARA P10276 1/20 0.48
RARG P13631 1/20 0.48
PGR P06401 1/20 0.41
MMP2 P08253 1/20 0.41
MMP3 P08254 1/20 0.41
HSD11B1 P28845 1/20 0.40
PTGS2 P35354 2/20 0.39
HTR2A P28223 2/20 0.39
S1PR1 P21453 1/20 0.39
AKR1C2 P52895 1/20 0.38
AKR1C1 Q04828 1/20 0.38
KCNH2 Q12809 3/20 0.38
GRM2 Q14416 1/20 0.38
HRH3 Q9Y5N1 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
SCHEMBL19270952 0.99 RARB (0.53) RARBRARARARGPGRMMP2
SCHEMBL19253582 0.95 RARB (0.56) RARBRARARARGHSD11B1HTR2A
SCHEMBL19253584 0.92 RARB (0.56) RARBRARARARGHSD11B1HTR2A
SCHEMBL8723123 0.87 RARB (0.59) RARBRARARARGHSD11B1HTR2A
SCHEMBL14175167 0.85 RARB (0.66) RARBRARARARGPTGS2HTR2A
SCHEMBL17586078 0.84 RARB (0.55) RARBRARARARGHTR2AKCNH2
SCHEMBL16258020 0.84 RARB (0.58) RARBRARARARGPTGS2HTR2A
SCHEMBL16258037 0.84 RARB (0.58) RARBRARARARGPTGS2HTR2A
SCHEMBL16258123 0.84 RARB (0.58) RARBRARARARGPTGS2HTR2A
SCHEMBL14175164 0.83 RARB (0.64) RARBRARARARGPTGS2HTR2A

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-10240088-B2 Substituted polyphenyls MERCK PATENT GMBH (DE) 2019-03-26 US disclosed
US-20170240812-A1 SUBSTITUTED POLYPHENYLS MERCK PATENT GMBH (DE) 2017-08-24 US disclosed
US-20170240812-A1 SUBSTITUTED POLYPHENYLS MERCK PATENT GMBH (DE) 2017-08-24 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-20170240812-A1 SUBSTITUTED POLYPHENYLS PDS5A, XPA, F2 RARB 3043/4885RARA 2927/4885RARG 3410/4885
US-10240088-B2 Substituted polyphenyls PDS5A, XPA, PDS5B RARB 3046/4885RARA 2896/4885RARG 3424/4885

“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.