SCHEMBL7101194

SCHEMBL7101194

Cc1cc(C(O)(C(F)(F)F)C(F)(F)F)ccc1N

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.55
TSHR P16473 2/20 0.47
ESR1 P03372 2/20 0.47
AR P10275 2/20 0.47
ESR2 Q92731 1/20 0.47
MEN1 O00255 1/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 1/20 0.47
NR1H2 P55055 10/20 0.47
NR1H3 Q13133 10/20 0.47
MLYCD O95822 1/20 0.46
ALDH1A1 P00352 1/20 0.45
CYP3A4 P08684 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
RORA P35398 1/20 0.42
RORC P51449 1/20 0.42

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
SCHEMBL5067200 0.86 SMN1; SMN2 (0.49) SMN1; SMN2TSHRARMEN1ALOX15
SCHEMBL4609823 0.83 SMN1; SMN2 (0.48) SMN1; SMN2TSHRARMEN1ALOX15
SCHEMBL19179688 0.82 ESR1 (0.46) SMN1; SMN2TSHRESR1ARESR2
SCHEMBL7102669 0.82 SMN1; SMN2 (0.44) SMN1; SMN2TSHRARMEN1ALOX15
SCHEMBL309960 0.81 NR1H2 (0.52) SMN1; SMN2TSHRARMEN1ALOX15
SCHEMBL11371728 0.80 SMN1; SMN2 (0.46) SMN1; SMN2TSHRARMEN1ALOX15
SCHEMBL29509486 0.80 MEN1 (0.47) SMN1; SMN2TSHRARMEN1ALOX15
SCHEMBL17709790 0.80 MEN1 (0.47) SMN1; SMN2TSHRARMEN1ALOX15
SCHEMBL13974786 0.80 SMN1; SMN2 (0.46) SMN1; SMN2TSHRARMEN1ALOX15
SCHEMBL2754718 0.79 SMN1; SMN2 (0.54) SMN1; SMN2TSHRARMEN1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240245633-A1 ROR Gamma Agonists as Enhancers of Protective Immunity UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2024-07-25 US disclosed
US-11084784-B2 ROR-gamma modulators and uses thereof Piramal Enterprises Limited (IN) 2021-08-10 US disclosed
CN-110272361-A The phthalic diamides compound of the hexafluoro isopropyl containing alkoxy and its application 华东理工大学 2019-09-24 CN disclosed
EP-3077372-B1 ROR GAMMA (RORY) MODULATORS LEAD PHARMA HOLDING BV (NL) 2019-02-06 EP disclosed
US-20180215707-A1 ROR-GAMMA MODULATORS AND USES THEREOF Piramal Enterprises Limited (IN) 2018-08-02 US disclosed
US-9738600-B2 ROR gamma (RORγ) modulators LEAD PHARMA CEL MODELS IP B.V. (NL) 2017-08-22 US disclosed
US-9738600-B2 ROR gamma (RORγ) modulators LEAD PHARMA CEL MODELS IP B.V. (NL) 2017-08-22 US disclosed
US-9586928-B2 Modulators of the nuclear hormone receptor ROR THE SCRIPPS RESEARCH INSTITUTE (US) 2017-03-07 US disclosed
US-9586928-B2 Modulators of the nuclear hormone receptor ROR THE SCRIPPS RESEARCH INSTITUTE (US) 2017-03-07 US disclosed
US-9586928-B2 Modulators of the nuclear hormone receptor ROR THE SCRIPPS RESEARCH INSTITUTE (US) 2017-03-07 US disclosed
US-20160304448-A1 ROR GAMMA (RORy) MODULATORS LEAD PHARMA CEL MODELS IP B.V. (NL) 2016-10-20 US disclosed
US-20160304448-A1 ROR GAMMA (RORy) MODULATORS LEAD PHARMA CEL MODELS IP B.V. (NL) 2016-10-20 US disclosed
EP-3077372-A1 ROR GAMMA (RORY) MODULATORS Lead Pharma Cel Models IP B.V. (NL) 2016-10-12 EP disclosed
WO-2015082533-A1 ROR GAMMA (RORY) MODULATORS LEAD PHARMA CEL MODELS IP B.V. (NL) 2015-06-11 WO disclosed
US-20140187554-A1 MODULATORS OF THE NUCLEAR HORMONE RECEPTOR ROR THE SCRIPPS RESEARCH INSTITUTE (US) 2014-07-03 US disclosed
WO-2012158784-A2 MODULATORS OF THE NUCLEAR HORMONE RECEPTOR ROR KAMENECKA THEODORE MARK (US) 2012-11-22 WO disclosed
WO-2003106435-A1 FUSED-RING PYRIMIDIN-4(3H)-ONE DERIVATIVES, PROCESSES FOR THE PREPARATION AND USES THEREOF SANKYO COMPANY, LIMITED (JP) 2003-12-24 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 (5 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-20240245633-A1 ROR Gamma Agonists as Enhancers of Protective Immunity RORC, RORB, RORA SMN1; SMN2 3772/4885TSHR 371/4885ESR1 1915/4885
US-20140187554-A1 MODULATORS OF THE NUCLEAR HORMONE RECEPTOR ROR RORB, RORA, RORC SMN1; SMN2 2502/4885TSHR 59/4885ESR1 505/4885
US-11084784-B2 ROR-gamma modulators and uses thereof RORB, RORA, RORC SMN1; SMN2 1625/4885TSHR 835/4885ESR1 879/4885
US-20180215707-A1 ROR-GAMMA MODULATORS AND USES THEREOF RORB, RORA, RORC SMN1; SMN2 1625/4885TSHR 835/4885ESR1 879/4885
US-20160304448-A1 ROR GAMMA (RORy) MODULATORS RORC, RORA, RORB SMN1; SMN2 3833/4885TSHR 167/4885ESR1 821/4885

“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.