SCHEMBL147030

SCHEMBL147030

CC(c1ccccc1)C(Cl)Cl

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
TAAR1 Q96RJ0 4/20 0.42
KDM4E B2RXH2 2/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2C P18825 1/20 0.41
CYP2D6 P10635 1/20 0.41
LMNA P02545 1/20 0.41
HIF1A Q16665 1/20 0.41
ALDH1A1 P00352 2/20 0.39
DPP4 P27487 2/20 0.39
F2 P00734 1/20 0.39
MIF P14174 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
SCHEMBL2240790 0.83 TSHR (0.52) TSHRTAAR1KDM4EADRA2AADRA2C
SCHEMBL20878794 0.83 TSHR (0.52) TSHRTAAR1KDM4EADRA2AADRA2C
SCHEMBL908216 0.82 TAAR1 (0.50) TSHRTAAR1KDM4EADRA2AADRA2C
SCHEMBL9750479 0.81 TSHR (0.50) TSHRTAAR1KDM4EADRA2AADRA2C
SCHEMBL10887464 0.79 LMNA (0.48) TSHRKDM4EADRA2AADRA2CCYP2D6
SCHEMBL10506295 0.79 ADRA2A (0.48) TSHRTAAR1KDM4EADRA2AADRA2C
SCHEMBL14685170 0.77 TSHR (0.46) TSHRTAAR1KDM4EADRA2AADRA2C
SCHEMBL19519886 0.77 TAAR1 (0.48) TSHRTAAR1KDM4EADRA2AADRA2C
SCHEMBL37100 0.77
SCHEMBL599878 0.77 TAAR1 (0.48) TSHRTAAR1KDM4EADRA2AADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107614555-A Method for producing thermoplastic elastomer and thermoplastic elastomer 株式会社钟化 2018-01-19 CN disclosed
US-20120059137-A1 MONODISPERSE CHLOROMETHYLSTYRENE POLYMER AND PRODUCING METHOD THEREOF AGC SEIMI CHEMICAL CO., LTD. (JP) 2012-03-08 US disclosed
EP-0849253-B1 Process for producing benzoyl chlorides MITSUBISHI GAS CHEMICAL CO (JP) 2001-05-16 EP disclosed
EP-1053990-A2 A method of producing an aromatic ketone and an aromatic ketone composition containing it TORAY INDUSTRIES, INC. (JP) 2000-11-22 EP disclosed
US-5872291-A Process for producing benzoyl chlorides MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1999-02-16 US disclosed
EP-0849253-A1 Process for producing benzoyl chlorides MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1998-06-24 EP disclosed