SCHEMBL2546337

SCHEMBL2546337

Nc1ccc(OCC2CC2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.47
HTR2B P41595 4/20 0.47
HTR2A P28223 3/20 0.47
TLR9 Q9NR96 2/20 0.44
TLR8 Q9NR97 2/20 0.44
TLR7 Q9NYK1 2/20 0.44
RIPK1 Q13546 1/20 0.41
KDM1A O60341 2/20 0.39
FFAR1 O14842 2/20 0.39
PPARD Q03181 2/20 0.39
FFAR4 Q5NUL3 1/20 0.39
PARP15 Q460N3 1/20 0.38
PARP10 Q53GL7 1/20 0.38
ACACB O00763 1/20 0.38
BRD4 O60885 1/20 0.38

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
SCHEMBL22069559 0.93 PARP10 (0.45) HTR2CHTR2BHTR2APARP15PARP10
SCHEMBL24968796 0.88 SCN9A (0.42) HTR2CHTR2BHTR2ATLR9TLR8
SCHEMBL13419711 0.87 TLR9 (0.43) HTR2BHTR2ATLR9TLR8TLR7
SCHEMBL28844733 0.86 HTR2C (0.43) HTR2CHTR2BHTR2ATLR9TLR8
SCHEMBL28333031 0.82 HTR2A (0.56) HTR2CHTR2BHTR2ATLR9TLR8
SCHEMBL10188111 0.81 DRD4 (0.41) HTR2AKDM1A
SCHEMBL13419709 0.80 EGFR (0.44) TLR9TLR8TLR7KDM1A
SCHEMBL11962822 0.79 HTR2A (0.43) HTR2CHTR2BHTR2ATLR9TLR8
SCHEMBL30781076 0.79 KMO (0.47) HTR2CHTR2BHTR2ARIPK1
SCHEMBL3988212 0.79 HTR2A (0.43) HTR2CHTR2BHTR2ATLR9TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4676926-A1 BICYCLIC HETEROARYL COMPOUNDS FOR USE AS GPR35 MODULATORS ThirtyFiveBio Limited (GB) 2026-01-14 EP disclosed
EP-4646402-A1 GPR35 MODULATORS ThirtyFiveBio Limited (GB) 2025-11-12 EP disclosed
WO-2024184650-A1 BICYCLIC HETEROARYL COMPOUNDS FOR USE AS GPR35 MODULATORS. ThirtyFiveBio Limited (GB) 2024-09-12 WO disclosed
WO-2024147009-A1 GPR35 MODULATORS ThirtyFiveBio Limited (GB) 2024-07-11 WO disclosed
US-9133129-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-15 US disclosed
EP-2563765-B1 BICYCLIC COMPOUND DERIVATIVES AND THEIR USE AS ACC INHIBITORS. TAKEDA PHARMACEUTICAL (JP) 2015-05-27 EP disclosed
CN-103025716-B Bicyclic compound derivatives and their use as acc inhibitors TAKEDA PHARMACEUTICAL 2014-12-24 CN disclosed
EP-2772485-A1 BICYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-09-03 EP disclosed
US-20140243310-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-28 US disclosed
CN-103998432-A Bicyclic compounds TAKEDA PHARMACEUTICAL 2014-08-20 CN disclosed
US-8703758-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-04-22 US disclosed
CN-103025716-A Bicyclic compound derivatives and their use as acc inhibitors TAKEDA PHARMACEUTICAL 2013-04-03 CN disclosed
EP-2563765-A1 BICYCLIC COMPOUND DERIVATIVES AND THEIR USE AS ACC INHIBITORS. Takeda Pharmaceutical Company Limited (JP) 2013-03-06 EP disclosed
WO-2011136385-A1 BICYCLIC COMPOUND DERIVATIVES AND THEIR USE AS ACC INHIBITORS. TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-11-03 WO disclosed
EP-2382218-A1 DELTA-5-DESATURASE INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2011-11-02 EP disclosed
US-20110263562-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-10-27 US disclosed
WO-2010087467-A1 DELTA-5-DESATURASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-05 WO disclosed
US-20100190747-A1 Fused ring compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-07-29 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 (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-20100190747-A1 Fused ring compound and use thereof CYP46A1, LTB4R2, PTGES HTR2C 2876/4885HTR2B 3020/4885HTR2A 3907/4885
US-20110263562-A1 BICYCLIC COMPOUND ACACA, CPT1B, ACACB HTR2C 4232/4885HTR2B 4791/4885HTR2A 4416/4885
US-20140243310-A1 BICYCLIC COMPOUND BICRA, NR3C2, CYP11B2 HTR2C 686/4885HTR2B 2650/4885HTR2A 2699/4885

“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.