SCHEMBL5530229

SCHEMBL5530229

CN(C)Cc1ccccc1.Cc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.56

Known targets — ChEMBL curated mechanism

ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.56
TSHR P16473 2/20 0.55
ALDH1A1 P00352 1/20 0.55
CNR2 P34972 8/20 0.54
TAS2R14 Q9NYV8 1/20 0.52
LIMK2 P53671 1/20 0.49
CYP1A2 P05177 2/20 0.48
CYP2C19 P33261 1/20 0.48
CNR1 P21554 2/20 0.48
BCHE P06276 1/20 0.47
ACHE P22303 1/20 0.47
CA12 O43570 1/20 0.47
CYP3A4 P08684 1/20 0.47
ATM Q13315 1/20 0.47
CA9 Q16790 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL15826671 0.90 TSHR (0.63) TSHRALDH1A1CNR2CA12CA9
SCHEMBL10719271 0.89 MCHR1 (0.67) MCHR1TSHRALDH1A1CNR2TAS2R14
SCHEMBL11614386 0.84 MCHR1 (0.61) MCHR1ALDH1A1CNR2TAS2R14CNR1
SCHEMBL10544587 0.84 TAAR1 (0.58) MCHR1ALDH1A1CNR2CYP1A2CYP2C19
SCHEMBL8143415 0.84 MCHR1 (0.56) MCHR1TSHRALDH1A1CNR2TAS2R14
SCHEMBL5743796 0.84 CNR2 (0.50) MCHR1CNR2TAS2R14LIMK2CNR1
Diphenylmethane SCHEMBL9099741 0.83 SMN1; SMN2 (0.54) MCHR1TSHRALDH1A1CNR2TAS2R14
Sulfuric Acid SCHEMBL6574025 0.82 ALDH1A1 (0.74) TSHRALDH1A1CA12CYP3A4CA9
Sulfuric Acid SCHEMBL6574021 0.82 ALDH1A1 (0.74) TSHRALDH1A1CA12CYP3A4CA9
SCHEMBL5744364 0.82 SIGMAR1 (0.51) MCHR1CNR2TAS2R14ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7244504-B2 Phenol-free decorative laminates and method of producing the same ACKNER FRITZ 2007-07-17 US disclosed
US-7235303-B2 Phenol-free decorative laminates and method of producing the same DAKOR MELAMIN IMPRAGNIERUNGEN GMBH (DE) 2007-06-26 US disclosed
US-20060228572-A1 Phenol-free decorative laminates and method of producing the same DAKOR MELAMIN IMPRAGNIERUNGEN GMBH (DE) 2006-10-12 US disclosed
US-20060182986-A1 Phenol-free decorative laminates and method of producing the same ACKNER FRITZ 2006-08-17 US disclosed
EP-1391478-A1 Phenol-free decorative laminate and method of producing same Cassaghi, Pietro (IT) 2004-02-25 EP disclosed