SCHEMBL20458673

SCHEMBL20458673

Clc1ccc(C2C(c3ccc(Cl)cc3)C2c2ccc(Cl)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
CYP2A6 P11509 1/20 0.57
RAB9A P51151 1/20 0.42
IDO1 P14902 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
HTR3A P46098 1/20 0.41
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
TSHR P16473 1/20 0.39
CYP1A2 P05177 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 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
SCHEMBL23744424 0.86 CES2 (0.48) LMNACYP2A6RAB9A
SCHEMBL12628506 0.78 MAOA (0.41) LMNACYP2A6RAB9ATAAR1HTR3A
1,4-Dichlorobenzene SCHEMBL11243685 0.76
1,4-Dichlorobenzene SCHEMBL5191 0.76
Hydrochloric Acid SCHEMBL15200728 0.74 KDM1A (0.39) LMNACYP2A6RAB9ATAAR1HTR2A
Hydrochloric Acid SCHEMBL15200649 0.74 KDM1A (0.39) LMNACYP2A6RAB9ATAAR1HTR2A
SCHEMBL10783623 0.71 MEN1 (0.52) LMNACYP2A6RAB9AIDO1HTR3A
SCHEMBL9819584 0.71 LMNA (0.47) LMNACYP2A6RAB9AIDO1TAAR1
SCHEMBL315186 0.71 HTR3A (0.58) LMNACYP2A6HTR3ATSHRCYP1A2
SCHEMBL9729085 0.71 LMNA (0.47) LMNACYP2A6RAB9AIDO1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3358409-B1 NEGATIVE-TYPE PHOTOSENSITIVE RESIN COMPOSITION, NEGATIVE-TYPE LITHOGRAPHIC PRINTING ORIGINAL PLATE, AND METHOD FOR PRODUCING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORP (JP) 2019-05-15 EP disclosed
EP-3358409-A1 NEGATIVE-TYPE PHOTOSENSITIVE RESIN COMPOSITION, NEGATIVE-TYPE LITHOGRAPHIC PRINTING ORIGINAL PLATE, AND METHOD FOR PRODUCING LITHOGRAPHIC PRINTING PLATE FUJIFILM Corporation (JP) 2018-08-08 EP disclosed