SCHEMBL7099525

SCHEMBL7099525

Cc1cc(N)ccc1C(O)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ PDE10A Q9Y233 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ GLA P06280 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ TSHR P16473 3/20 0.41
▸ CASP1 P29466 2/20 0.41
▸ AR P10275 3/20 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
SCHEMBL16799846 0.92 SMN1; SMN2 (0.46) SMN1; SMN2PDE10AALDH1A1MEN1KMT2A
SCHEMBL5351652 0.80 ALDH1A1 (0.48) SMN1; SMN2PDE10AALDH1A1MEN1KMT2A
SCHEMBL9198448 0.80 ALDH1A1 (0.48) SMN1; SMN2PDE10AALDH1A1MEN1KMT2A
SCHEMBL2994229 0.80 ALDH1A1 (0.48) SMN1; SMN2PDE10AALDH1A1MEN1KMT2A
SCHEMBL1333739 0.80 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1MEN1KMT2AKDM4E
SCHEMBL24719100 0.80 MEN1 (0.58) SMN1; SMN2MEN1KMT2AMAPK1HSD17B10
SCHEMBL12724450 0.80 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1MEN1KMT2AKDM4E
SCHEMBL29938143 0.80 ALDH1A1 (0.48) SMN1; SMN2PDE10AALDH1A1MEN1KMT2A
SCHEMBL2059016 0.79 TSHR (0.56) SMN1; SMN2PDE10AALDH1A1MEN1KMT2A
SCHEMBL30750882 0.79 TSHR (0.56) SMN1; SMN2PDE10AALDH1A1MEN1KMT2A

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 15 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
CN-110272361-B Phthalic diamide compound containing alkoxy hexafluoroisopropyl and application thereof 华东理工大学 2021-06-11 — — CN disclosed
CN-105980353-B ROR gamma modulators 领先制药控股公司 2019-06-14 — — CN disclosed
EP-3077372-B1 ROR GAMMA (RORY) MODULATORS LEAD PHARMA HOLDING BV (NL) 2019-02-06 — — EP 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
CN-105980353-A ROR gamma modulators 领先制药CEL模型知识产权公司 2016-09-28 — — CN 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 (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-20240245633-A1 ROR Gamma Agonists as Enhancers of Protective Immunity RORC, RORB, RORA SMN1; SMN2 3772/4885PDE10A 3649/4885ALDH1A1 1575/4885
US-20140187554-A1 MODULATORS OF THE NUCLEAR HORMONE RECEPTOR ROR RORB, RORA, RORC SMN1; SMN2 2502/4885PDE10A 2860/4885ALDH1A1 1704/4885
US-20160304448-A1 ROR GAMMA (RORy) MODULATORS RORC, RORA, RORB SMN1; SMN2 3833/4885PDE10A 1137/4885ALDH1A1 1054/4885

“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.

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