SCHEMBL7573550

SCHEMBL7573550

COc1ccc(C2Cc3cc(OC)ccc3C2=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 4/20 0.56
CYP19A1 P11511 5/20 0.51
ALOX15 P16050 1/20 0.50
ALOX12 P18054 1/20 0.50
ALDH1A1 P00352 2/20 0.49
MAP2K3 P46734 1/20 0.49
CYP3A4 P08684 1/20 0.49
MAOB P27338 1/20 0.49
ACHE P22303 1/20 0.49
KCNH2 Q12809 1/20 0.45
TRPV1 Q8NER1 1/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
MAOA P21397 1/20 0.45
PTGS2 P35354 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HTR2A P28223 1/20 0.44

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
SCHEMBL9146594 0.91 CYP19A1 (0.63) METAP1CYP19A1ALDH1A1MAOBHTR2A
SCHEMBL4422957 0.88 ACHE (0.65) METAP1CYP19A1ALOX15ALOX12ALDH1A1
SCHEMBL6286139 0.87 CYP19A1 (0.55) METAP1CYP19A1ALDH1A1CYP3A4MAOB
SCHEMBL16013457 0.85 METAP1 (0.51) METAP1CYP19A1ALDH1A1ACHEHTR2A
SCHEMBL6669546 0.85 CYP24A1 (0.53) METAP1CYP19A1ALOX15ALOX12HTR2A
SCHEMBL22204650 0.85 METAP1 (0.45) METAP1CYP19A1ALOX15ALOX12ALDH1A1
SCHEMBL9148955 0.84 CYP19A1 (0.59) CYP19A1ALOX15ALOX12ALDH1A1MAP2K3
SCHEMBL13885522 0.82 CYP24A1 (0.48) METAP1CYP19A1ALOX15ALOX12ALDH1A1
SCHEMBL3654990 0.82 CYP24A1 (0.48) METAP1CYP19A1ALOX15ALOX12ALDH1A1
SCHEMBL29218130 0.81 MAP2K3 (0.47) CYP19A1ALOX15ALOX12ALDH1A1MAP2K3

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
EP-0873992-B1 Indene compounds having activity as SERMs LILLY CO ELI (US) 2002-09-25 EP disclosed
US-5994370-A ESTROGEN RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 1999-11-30 US disclosed
WO-1998048806-A1 INDENE COMPOUNDS HAVING ACTIVITY AS SERMS ELI LILLY AND COMPANY (US) 1998-11-05 WO disclosed
EP-0873992-A1 Indene compounds having activity as SERMs ELI LILLY AND COMPANY (US) 1998-10-28 EP disclosed
US-5021414-A Antiestrogen IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-06-04 US disclosed
US-4904661-A ANTIESTROGENS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-02-27 US disclosed
US-4732912-A ANTIESTROGENS, ANTITUMOR AGENTS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-03-22 US disclosed
EP-0124369-B1 PHENOL DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-06-24 EP disclosed
EP-0124369-A1 Phenol derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-07 EP disclosed