SCHEMBL8073852

SCHEMBL8073852

CCOC(=O)c1c(C(=O)c2cc3c(cc2N)OCO3)nnn1Cc1ccc(OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.51
RECQL P46063 2/20 0.44
UCHL1 P09936 1/20 0.44
MAPT P10636 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 3/20 0.43
NPC1 O15118 1/20 0.43
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
POLB P06746 3/20 0.43
RXFP1 Q9HBX9 1/20 0.43
ALOX15 P16050 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TP53 P04637 1/20 0.42
HSD17B10 Q99714 3/20 0.42
HPGD P15428 2/20 0.42
ALDH1A1 P00352 3/20 0.42

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
SCHEMBL8071479 0.93 CYP19A1 (0.54) CYP19A1RECQLUCHL1MAPTSMN1; SMN2
SCHEMBL8068983 0.87 ALDH1A1 (0.51) CYP19A1RECQLUCHL1MAPTSMN1; SMN2
SCHEMBL7815561 0.85 POLB (0.46) CYP19A1RECQLUCHL1MAPTSMN1; SMN2
SCHEMBL7829087 0.85 POLB (0.48) CYP19A1UCHL1MAPTSMN1; SMN2MEN1
SCHEMBL8057540 0.83 HSD17B10 (0.44) CYP19A1RECQLUCHL1MAPTSMN1; SMN2
SCHEMBL7827011 0.82 POLB (0.50) RECQLUCHL1MAPTSMN1; SMN2MEN1
SCHEMBL8057633 0.81 POLB (0.44) CYP19A1RECQLUCHL1MAPTSMN1; SMN2
SCHEMBL8071978 0.81 HSD17B10 (0.44) CYP19A1RECQLUCHL1MAPTSMN1; SMN2
SCHEMBL8057862 0.81 HSD17B10 (0.44) CYP19A1RECQLUCHL1MAPTSMN1; SMN2
SCHEMBL8068083 0.81 AKR1C3 (0.48) CYP19A1RECQLUCHL1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6093714-A AN ANTIALLERGENS FOR TREATMENT AND PREVENTION OF BRONCHIAL ASTHMA, ECZEMA, HIVES, ALLERGIC GASTROINTESTINAL TROUBLES, ALLERGIC RHINITIS, ALLERGIC CONJUNCTIVITIS MEIJI SEIKA KAISHA, LTD. (JP) 2000-07-25 US disclosed
EP-0834512-A1 TRICYCLIC BENZAZEPINE COMPOUNDS MEIJI SEIKA KAISHA LTD. (JP) 1998-04-08 EP disclosed