SCHEMBL4332836

SCHEMBL4332836

C=C(C)C(=O)Oc1ccc(C(CC)c2ccc(O)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.50
KMT2A Q03164 2/20 0.43
ATM Q13315 1/20 0.43
ESR1 P03372 3/20 0.42
HIF1A Q16665 1/20 0.42
LMNA P02545 2/20 0.40
CYP2C9 P11712 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
CYP1A2 P05177 1/20 0.40
PGR P06401 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
AR P10275 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
CHRM1 P11229 1/20 0.40
ALOX15 P16050 1/20 0.40
DRD1 P21728 1/20 0.40
TBXA2R P21731 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
SCHEMBL4122942 0.94 ELANE (0.55) ELANEKMT2AATMESR1HIF1A
SCHEMBL12521562 0.84 LMNA (0.47) ELANEESR1HIF1ALMNACYP2C9
SCHEMBL72362 0.84 ELANE (0.61) ELANEKMT2AATMESR1LMNA
SCHEMBL587543 0.83 ESR1 (0.52) ELANEKMT2AATMESR1HIF1A
SCHEMBL10591542 0.83 ESR1 (0.47) ELANEESR1HIF1ALMNACYP2C9
Methacrylic Acid SCHEMBL10431269 0.82 ESR1 (0.48) ESR1LMNACYP2C9TDP1CYP1A2
Methacrylic Acid SCHEMBL8512987 0.82 ELANE (0.60) ELANEKMT2AATMESR1LMNA
SCHEMBL819794 0.80 ALDH1A1 (0.54) ELANEKMT2AATMESR1HIF1A
SCHEMBL217004 0.79 ELANE (0.56) ELANEKMT2AATMESR1LMNA
Hydroquinone SCHEMBL28395727 0.78 ELANE (0.64) ELANEKMT2AATMTDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009146400-A1 PHOTOSENSITIVE PASTE AND SINTERED LAYER E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-12-03 WO disclosed