SCHEMBL8465475

SCHEMBL8465475

O=C1c2cc(O)ccc2CCC1Cc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 5/20 0.78
CYP26A1 O43174 7/20 0.68
CYP24A1 Q07973 1/20 0.55
ESR1 P03372 5/20 0.55
ESR2 Q92731 5/20 0.55
HTR1A P08908 1/20 0.50
SIGMAR1 Q99720 1/20 0.50
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TP53 P04637 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
MAPT P10636 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL8158688 0.89 CYP26A1 (0.86) CYP19A1CYP26A1CYP24A1ESR1ESR2
SCHEMBL8466193 0.87 CYP19A1 (0.60) CYP19A1CYP26A1CYP24A1SIGMAR1
SCHEMBL29679345 0.86 CYP19A1 (0.59) CYP19A1CYP26A1CYP24A1HTR1ASIGMAR1
SCHEMBL28733931 0.86 CYP19A1 (0.59) CYP19A1CYP26A1CYP24A1HTR1ASIGMAR1
SCHEMBL10686519 0.86 CYP19A1 (0.59) CYP19A1CYP26A1CYP24A1HTR1ASIGMAR1
SCHEMBL29679745 0.83 CYP19A1 (0.57) CYP19A1CYP26A1CYP24A1HTR1ASIGMAR1
SCHEMBL28733980 0.83 CYP19A1 (0.57) CYP19A1CYP26A1CYP24A1HTR1ASIGMAR1
SCHEMBL28733983 0.83 CYP19A1 (0.57) CYP19A1CYP26A1CYP24A1HTR1ASIGMAR1
SCHEMBL28733973 0.83 CYP19A1 (0.57) CYP19A1CYP26A1CYP24A1HTR1ASIGMAR1
SCHEMBL29679305 0.83 CYP19A1 (0.57) CYP19A1CYP26A1CYP24A1HTR1ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5998451-A LIPOXYGENASE INHIBITORS PFIZER INC (US) 1999-12-07 US disclosed
CN-1021823-C Substituted chroman compounds for treatment of asthma, arthritis and the like PFIZER (US) 1993-08-18 CN disclosed
EP-0313295-B1 SUBSTITUTED TETRALINS, CHROMANS AND RELATED COMPOUNDS IN THE TREATMENT OF ASTHMA, ARTHRITIS AND RELATED DISEASES PFIZER INC. (US) 1993-07-28 EP disclosed
CN-1064864-A The tetraline that replaces and the preparation method of allied compound PFIZER (US) 1992-09-30 CN disclosed
CN-1063489-A Substituted benzotetrahydropyridines and related compounds PFIZER (US) 1992-08-12 CN disclosed
US-5059609-A Lipoxygenase inhibitors; leukotriene receptor blockers; psoriasis; antiulcer agents and myocardial infarctions PFIZER INC. (US) 1991-10-22 US disclosed
CN-1032659-A Substituted tetralins, chromans and like compounds for the treatment of asthma, arthritis and like diseases PFIZER (US) 1989-05-03 CN disclosed
EP-0313295-A2 Substituted tetralins, chromans and related compounds in the treatment of asthma, arthritis and related diseases PFIZER INC. (US) 1989-04-26 EP disclosed