SCHEMBL8917246

SCHEMBL8917246

Fc1cc(Cc2cccs2)c(Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
CYP2C9 P11712 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
ADCY10 Q96PN6 1/20 0.38
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
ADRA1D P25100 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35
DRD4 P21917 1/20 0.35

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
SCHEMBL8916008 0.92 TAAR1 (0.40) TAAR1NPC1RAB9AL3MBTL1CYP2C9
SCHEMBL11314534 0.86 L3MBTL1 (0.46) TAAR1NPC1RAB9AL3MBTL1CYP2C9
SCHEMBL4863794 0.76 NPC1 (0.57) NPC1RAB9AL3MBTL1CYP2C9ALDH1A1
SCHEMBL24105617 0.73 L3MBTL1 (0.42) TAAR1NPC1RAB9AL3MBTL1CYP2C9
SCHEMBL9024874 0.73 HPGD (0.54) TAAR1NPC1RAB9AL3MBTL1CYP2C9
SCHEMBL646103 0.73 ABL1 (0.47) TAAR1NPC1RAB9ACYP2C9ALDH1A1
SCHEMBL28468257 0.72 MEN1 (0.46) TAAR1RAB9ACYP2C9PTGS1PTGS2
SCHEMBL7025724 0.72 MEN1 (0.49) TAAR1RAB9ACYP2C9PTGS1PTGS2
SCHEMBL3456460 0.70 HPGD (0.44) TAAR1CYP2C9PTGS1PTGS2ALDH1A1
SCHEMBL9353749 0.70 LMNA (0.41) TAAR1NPC1RAB9ACYP2C9PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5591869-A Process for the preparation of methylene compounds and the novel compound 2-(2,4-Dichloro-5-fluorobenzyl)thiophene BAYER AKTIENGESELLSCHAFT (DE) 1997-01-07 US claimed
EP-0719771-A1 Process for the preparation of methylene compounds and the compound 2-(2',4'-dichloro-5'-fluorobenzyl)-thiophene BAYER AG (DE) 1996-07-03 EP claimed
JP-8239375-A None JP disclosed
US-5591869-A Process for the preparation of methylene compounds and the novel compound 2-(2,4-Dichloro-5-fluorobenzyl)thiophene BAYER AKTIENGESELLSCHAFT (DE) 1997-01-07 US disclosed
US-5591869-A Process for the preparation of methylene compounds and the novel compound 2-(2,4-Dichloro-5-fluorobenzyl)thiophene BAYER AKTIENGESELLSCHAFT (DE) 1997-01-07 US disclosed
US-5591869-A Process for the preparation of methylene compounds and the novel compound 2-(2,4-Dichloro-5-fluorobenzyl)thiophene BAYER AKTIENGESELLSCHAFT (DE) 1997-01-07 US disclosed
JP-H08239375-A PROCESS FOR PRODUCING METHYLENE COMPOUND AND NEW COMPOUND 2-(2,4-DICHLORO-5-FLUOROBENZYL) THIOPHENE BAYER AG 1996-09-17 JP disclosed
EP-0719771-A1 Process for the preparation of methylene compounds and the compound 2-(2',4'-dichloro-5'-fluorobenzyl)-thiophene BAYER AG (DE) 1996-07-03 EP disclosed
EP-0719771-A1 Process for the preparation of methylene compounds and the compound 2-(2',4'-dichloro-5'-fluorobenzyl)-thiophene BAYER AG (DE) 1996-07-03 EP disclosed
EP-0719771-A1 Process for the preparation of methylene compounds and the compound 2-(2',4'-dichloro-5'-fluorobenzyl)-thiophene BAYER AG (DE) 1996-07-03 EP disclosed