SCHEMBL9486994

SCHEMBL9486994

O=C(Oc1ccc(Cl)cc1)C(Cl)(Cl)Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.58
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
PPARA Q07869 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 2/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
LIPE Q05469 2/20 0.43
ABCB11 O95342 1/20 0.43
TSHR P16473 1/20 0.43
HTR2A P28223 1/20 0.43
PMP22 Q01453 1/20 0.43
HPGD P15428 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40

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
SCHEMBL1456652 0.91 ELANE (0.52) ELANEMEN1KMT2ASMN1; SMN2HTT
SCHEMBL197454 0.81 ELANE (0.83) ELANECYP1A2CYP3A4PPARAMEN1
SCHEMBL988598 0.81 LMNA (0.57) ELANECYP1A2KMT2ACYP2C19
SCHEMBL10738024 0.81 ELANE (0.56) ELANECYP1A2CYP3A4PPARAMEN1
SCHEMBL11227350 0.81 ELANE (0.44) ELANEMEN1KMT2AMAPT
SCHEMBL987567 0.80 ELANE (0.47) ELANECYP1A2MEN1KMT2AMAPT
SCHEMBL14155820 0.79 HSD17B10 (0.52) ELANEKMT2ATSHR
SCHEMBL10778751 0.79 ELANE (0.64) ELANECYP1A2CYP3A4PPARAMEN1
SCHEMBL9541895 0.78 KMT2A (0.49) ELANECYP1A2MEN1KMT2AMAPT
SCHEMBL11221408 0.78 ELANE (0.55) ELANEMEN1KMT2ATSHRHPGD

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
US-4334111-A PYROLYSIS OF PHENYL TRIHALOACETATE THE DOW CHEMICAL COMPANY (US) 1982-06-08 US claimed
EP-0341585-B1 PRODUCTION OF 3,5,6-TRICHLORO-PYRIDIN-2-OL AND NOVEL INTERMEDIATES THEREOF LUXEMBOURG INDUSTRIES (PAMOL) LTD. (IL) 1993-01-13 EP disclosed
US-5017705-A Production of 3,5,6-trichloropyridin-2 ol and novel intermediates thereof LUXEMBOURG INDUSTRIES (PAMOL) LTD. (IL) 1991-05-21 US disclosed
EP-0341585-A1 Production of 3,5,6-trichloro-pyridin-2-ol and novel intermediates thereof LUXEMBOURG INDUSTRIES (PAMOL) LTD. (IL) 1989-11-15 EP disclosed
US-4334111-A PYROLYSIS OF PHENYL TRIHALOACETATE THE DOW CHEMICAL COMPANY (US) 1982-06-08 US disclosed
US-4334111-A PYROLYSIS OF PHENYL TRIHALOACETATE THE DOW CHEMICAL COMPANY (US) 1982-06-08 US disclosed