SCHEMBL16245147

SCHEMBL16245147

O=C(CI)c1cc(-c2cccc(F)c2)ccc1F

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DCLRE1B Q9H816 1/20 0.48
ESR2 Q92731 1/20 0.46
TAAR1 Q96RJ0 3/20 0.44
PTGER2 P43116 6/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
MAP4K4 O95819 1/20 0.40
PTPN1 P18031 1/20 0.40
ICMT O60725 1/20 0.39
FFAR1 O14842 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39
CYP17A1 P05093 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39

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
SCHEMBL2160051 0.80 DCLRE1B (0.60) DCLRE1BESR2HCAR2
SCHEMBL29363677 0.80 DCLRE1B (0.60) DCLRE1BESR2HCAR2
SCHEMBL14783967 0.79 ESR2 (0.50) DCLRE1BESR2TAAR1CES2CES1
SCHEMBL12352001 0.79 MAP4K4 (0.56) DCLRE1BESR2TAAR1CES2CES1
SCHEMBL29188757 0.75 SLC6A4 (0.49) DCLRE1BESR2TAAR1PTGER2
SCHEMBL18759259 0.74 CYP1A2 (0.56) DCLRE1BESR2TAAR1MAP4K4CYP3A4
SCHEMBL14786153 0.74 TRPM8 (0.53) DCLRE1BESR2TAAR1PTGER2MAP4K4
SCHEMBL14252243 0.71 DCLRE1B (0.67) DCLRE1BESR2TAAR1HCAR2
SCHEMBL14241077 0.71 MAPT (0.56) DCLRE1BFFAR1
SCHEMBL16619526 0.71 CES2 (0.61) CES2CES1

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-9624159-B2 Aniline derivatives, their preparation and their therapeutic application SANOFI (FR) 2017-04-18 US disclosed
US-20160199330-A1 ANILINE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2016-07-14 US disclosed
US-9249085-B2 Aniline derivatives, their preparation and their therapeutic application FOVEA PHARMACEUTICALS (FR) 2016-02-02 US disclosed
US-20140350019-A1 ANILINE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION FOVEA PHARMACEUTICALS (FR) 2014-11-27 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-20140350019-A1 ANILINE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION CYP11B1, CYP11B2, ARG2 DCLRE1B 4648/4885ESR2 1310/4885TAAR1 834/4885
US-20160199330-A1 ANILINE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION CYP11B1, ARG2, CYP11B2 DCLRE1B 4593/4885ESR2 1213/4885TAAR1 831/4885

“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.