SCHEMBL8236376

SCHEMBL8236376

CCOc1ccc(Br)cc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 1/20 0.50
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
RXRG P48443 1/20 0.50
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.46
CTSS P25774 7/20 0.46
CTSK P43235 5/20 0.43
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
LMNA P02545 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
AR P10275 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL30006527 0.87 S1PR4 (0.46) S1PR4RXRARXRBRXRGHPGD
SCHEMBL18704596 0.86 S1PR4 (0.54) S1PR4RXRARXRBRXRGHPGD
SCHEMBL13748304 0.84 PTGDR2 (0.64) HPGDTSHRPTGDR2LMNARAB9A
SCHEMBL16585038 0.83 S1PR4 (0.44) S1PR4RXRARXRBRXRGHPGD
SCHEMBL3587016 0.83 S1PR4 (0.48) S1PR4PTGDR2
SCHEMBL2950931 0.82 S1PR1 (0.55) S1PR4HPGDPTGDR2LMNARAB9A
SCHEMBL22289887 0.81 PTGDR2 (0.53) S1PR4RXRARXRBRXRGHPGD
SCHEMBL12144509 0.80 PTGDR2 (0.49) S1PR4RXRARXRBRXRGPTGDR2
SCHEMBL8280909 0.80 AR (0.53) RXRARXRBRXRGHPGDTSHR
SCHEMBL2273425 0.79 S1PR4 (0.44) S1PR4HPGDTSHRPTGDR2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410756-B Liquid crystal compound containing polyfluorofenanthrene structure and application thereof 北京云基科技股份有限公司 2025-04-11 CN disclosed
CN-116410756-A Liquid crystal compound containing polyfluorofenanthrene structure and application thereof 北京云基科技股份有限公司 2023-07-11 CN disclosed
EP-4126840-A1 ARYL PIPERIDINES AS MONOACYLGLYCEROL LIPASE MODULATORS Janssen Pharmaceutica NV (BE) 2023-02-08 EP disclosed
WO-2021191384-A1 ARYL PIPERIDINES AS MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2021-09-30 WO disclosed
EP-1979351-B1 6-PHENYL-1H-IMIDAZO[4, 5-C]PYRIDINE-4-CARBONITRILE DERIVATIVES AS CATHEPSIN K AND S INHIBITORS ORGANON NV (NL) 2010-04-07 EP disclosed
US-7687515-B2 6-phenyl-1H-imidazo[4,5-c]pyridine-4-carbonitrile derivatives N.V. ORGANON (NL) 2010-03-30 US disclosed
US-7687515-B2 6-phenyl-1H-imidazo[4,5-c]pyridine-4-carbonitrile derivatives N.V. ORGANON (NL) 2010-03-30 US disclosed
CN-101516845-A Preparation method of 2, 5-bis (2,2, 2-trifluoroethoxy) -N- (2-piperidylmethyl) -benzamide and salt thereof GRINDEKS JSC (LV) 2009-08-26 CN disclosed
CN-101516817-A Process for the preparation of trifluoroethoxytoluenes GRINDEKS JSC (LV) 2009-08-26 CN disclosed
US-20070179138-A1 6-Phenyl-1H-imidazo[4,5-c]pyridine-4-carbonitrile derivatives N.V. ORGANON (NL) 2007-08-02 US disclosed
US-20070179138-A1 6-Phenyl-1H-imidazo[4,5-c]pyridine-4-carbonitrile derivatives N.V. ORGANON (NL) 2007-08-02 US disclosed
WO-2007080191-A1 6-PHENYL-1H-IMIDAZO[4, 5-C]PYRIDINE-4-CARBONITRILE DERIVATIVES AS CATHEPSIN K AND S INHIBITORS N.V. ORGANON (NL) 2007-07-19 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-20070179138-A1 6-Phenyl-1H-imidazo[4,5-c]pyridine-4-carbonitrile derivatives CTSK, CTSS, CTSZ S1PR4 1887/4885RXRA 2047/4885RXRB 2217/4885

“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.