SCHEMBL6793622

SCHEMBL6793622

C[Si](C)(C)Oc1ccc(C(=O)Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
HPGD P15428 5/20 0.39
MAPT P10636 2/20 0.39
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
RAB9A P51151 1/20 0.39
CA1 P00915 4/20 0.38
CA2 P00918 4/20 0.38
ELANE P08246 2/20 0.37
PARP10 Q53GL7 2/20 0.36
PARP4 Q9UKK3 2/20 0.36
PARP1 P09874 1/20 0.36
PARP2 Q9UGN5 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
ESR1 P03372 2/20 0.36
HIF1A Q16665 2/20 0.36
KMT2A Q03164 2/20 0.36
RECQL P46063 1/20 0.36
TSHR P16473 2/20 0.35
HTT P42858 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
SCHEMBL9339181 0.83 ELANE (0.53) ALDH1A1HPGDMAPTRAB9AELANE
SCHEMBL7291293 0.81 PREP (0.45) ALDH1A1HPGDMAPTCES2CES1
SCHEMBL8831777 0.81 MAPT (0.61) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL3519634 0.79 KDM4E (0.31) CES2CES1HTTKDM4ELMNA
SCHEMBL7902130 0.79 GLRA1 (0.31) CES2CES1
SCHEMBL6307030 0.79 KMT2A (0.39) ALDH1A1HPGDMAPTCES2CES1
SCHEMBL7543816 0.78 CA1 (0.64) ALDH1A1MAPTRAB9ACA1CA2
SCHEMBL7912420 0.77 CES2 (0.46) ALDH1A1CES2CES1RAB9APARP1
SCHEMBL4763549 0.76 CA1 (0.39) ALDH1A1CA1CA2KMT2AMAPK1
SCHEMBL9339629 0.76 ELANE (0.61) ALDH1A1HPGDMAPTCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1308297-C Phenyl sulfamate derivs. TEIKOKU HORMONE MFG CO LTD (JP) 2007-04-04 CN disclosed
US-6762205-B1 STEROID SULFATASE INHIBITORS WITHOUT ESTROGENIC SIDE EFFECT ACTION TEIKOKU HORMONE MFG. CO., LTD. (JP) 2004-07-13 US disclosed
CN-1360570-A Phenyl sulfamate derivs. TEIKOKU HORMONE MFG CO LTD (JP) 2002-07-24 CN disclosed
EP-1193250-A1 PHENYL SULFAMATE DERIVATIVES Teikoku Hormone Mfg. Co., Ltd. (JP) 2002-04-03 EP disclosed
EP-0598756-B1 ESTER COMPOSITION SHELL INT RESEARCH (NL) 1996-06-05 EP disclosed
US-5332858-A Esterification with active phenolic ether and chloroformyl group and active phenol SHELL OIL COMPANY (US) 1994-07-26 US disclosed
EP-0598756-A1 ESTER COMPOSITION. SHELL INT RESEARCH (NL) 1994-06-01 EP disclosed
US-5211877-A Crosslinked resins CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1993-05-18 US disclosed
WO-1993002038-A1 ESTER COMPOSITION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1993-02-04 WO disclosed