SCHEMBL27640685

SCHEMBL27640685

CCN1c2ccccc2OC1C

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NISCH Q9Y2I1 1/20 0.38
▸ KMT2A Q03164 2/20 0.37
▸ TSHR P16473 3/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ ABCB11 O95342 1/20 0.36
▸ ADRA2B P18089 1/20 0.36
▸ HTT P42858 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ P2RX4 Q99571 1/20 0.34

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
Iodide SCHEMBL11688375 0.98 NISCH (0.37) NISCHKMT2ATSHRCYP1A2CYP3A4
SCHEMBL16709153 0.86 TSHR (0.36) KMT2ATSHRADRA2BHTTALDH1A1
SCHEMBL25415493 0.79 BRD4 (0.47) NISCHKMT2ATSHRHTTMEN1
SCHEMBL11007300 0.74 SMN1; SMN2 (0.50) NISCHKMT2ATSHRCYP1A2CYP3A4
SCHEMBL7766488 0.74 HTT (0.35) NISCHKMT2ATSHRHTTALDH1A1
SCHEMBL29986485 0.73 TSHR (0.32) NISCHKMT2ATSHRCYP1A2CYP3A4
SCHEMBL6947699 0.73 TSHR (0.32) NISCHKMT2ATSHRCYP1A2CYP3A4
SCHEMBL11688379 0.73 — —
SCHEMBL20027221 0.72 GPR3 (0.39) NISCHTSHRHTTALDH1A1L3MBTL1
SCHEMBL16728888 0.72 GPR3 (0.39) NISCHTSHRHTTALDH1A1L3MBTL1

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-101802107-A Dye composition comprising at least one colourless disulfide/thiol precursor and dyeing process using said composition OREAL 2010-08-11 — — CN claimed
CN-102782932-B Photo-electric conversion element and pigment for use with photoelectric conversion element ADEKA CORP. (JP) 2015-08-05 — — CN disclosed
CN-101910229-B Onium salt-containing polymer NIPPON SODA CO 2013-01-30 — — CN disclosed
CN-101802107-A Dye composition comprising at least one colourless disulfide/thiol precursor and dyeing process using said composition OREAL 2010-08-11 — — CN disclosed
CN-1860135-A Arylsulfinate salts in photoinitiator systems for polymerization reactions 3M INNOVATIVE PROPERTIES CO (US) 2006-11-08 — — CN disclosed
CN-1860134-A Arylsulfinate salts in initiator systems for polymeric reactions 3M INNOVATIVE PROPERTIES CO (US) 2006-11-08 — — CN disclosed
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