SCHEMBL11056958

SCHEMBL11056958

COc1cccc(OC)c1CN1C(=O)C2CCCN2c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.50
▸ HTR1A P08908 1/20 0.47
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KDM4E B2RXH2 4/20 0.46
▸ ALDH1A1 P00352 4/20 0.46
▸ RECQL P46063 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ HPGD P15428 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL11055326 0.85 MEN1 (0.66) RAB9AHTR1AKMT2AMEN1KDM4E
SCHEMBL11056954 0.78 KMT2A (0.58) KMT2AMEN1KDM4EALDH1A1RECQL
SCHEMBL13879410 0.75 KDM4E (0.57) RAB9AHTR1AKMT2AMEN1KDM4E
SCHEMBL11061243 0.74 KMT2A (0.60) HTR1AKMT2AMEN1KDM4EALDH1A1
SCHEMBL11056757 0.73 MAPT (0.46) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL11061195 0.73 POLB (0.52) HTR1AKMT2AMEN1KDM4EALDH1A1
SCHEMBL13879455 0.71 KDM4E (0.56) RAB9AKMT2AMEN1KDM4EALDH1A1
SCHEMBL11825396 0.67 AADAT (0.49) KMT2AMEN1KDM4EALDH1A1RECQL
SCHEMBL11821643 0.67 AADAT (0.46) RAB9AKDM4EALDH1A1RECQLPOLB
SCHEMBL5746794 0.66 HTR1A (0.60) HTR1ASMN1; 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-4446323-A Tetra- and hexa-hydropyrrolo(1,2-a)quinoxaline and azaquinoxaline derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1984-05-01 — — US claimed
US-4446323-A Tetra- and hexa-hydropyrrolo(1,2-a)quinoxaline and azaquinoxaline derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1984-05-01 — — US disclosed
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