SCHEMBL9404866

SCHEMBL9404866

COc1ccc(N)c2c1N(C(C)=O)CCC2=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.47
▸ MAPT P10636 2/20 0.47
▸ NOTUM Q6P988 5/20 0.44
▸ ALDH1A1 P00352 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ GLA P06280 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ FGB P02675 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ ADORA2A P29274 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ NCOA2 Q15596 1/20 0.38
▸ NCOA1 Q15788 1/20 0.38

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
SCHEMBL9404793 0.82 NOTUM (0.42) MAPTNOTUMPOLBMEN1KMT2A
SCHEMBL9404923 0.72 KMT2A (0.45) ALDH1A1MEN1RAB9AKMT2AMAOB
SCHEMBL9042960 0.72 MAPT (0.43) LMNAMAPTALDH1A1KDM4EHPGD
SCHEMBL9404807 0.71 ALDH1A1 (0.73) LMNAMAPTALDH1A1KDM4EGLA
SCHEMBL21232729 0.70 NOTUM (0.63) LMNANOTUMALDH1A1SMN1; SMN2TRIM24
SCHEMBL9041741 0.69 ALDH1A1 (0.59) LMNAMAPTALDH1A1KDM4EGLA
Hydrochloric Acid SCHEMBL9404913 0.68 ALDH1A1 (0.57) LMNAMAPTALDH1A1KDM4EGLA
SCHEMBL6273537 0.68 NOTUM (0.57) LMNAMAPTNOTUMALDH1A1KDM4E
SCHEMBL29187823 0.68 NOTUM (0.47) LMNAMAPTNOTUMALDH1A1KDM4E
SCHEMBL10689221 0.65 NOTUM (0.41) LMNAMAPTNOTUMALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0296597-B1 Hexa-cyclic compound DAIICHI SEIYAKU CO (JP) 1994-09-21 — — EP disclosed
US-5061795-A ANTITUMOR AGENTS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1991-10-29 — — US disclosed
US-4939255-A Hexa-cyclic camptothecin derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1990-07-03 — — US disclosed
EP-0296597-A2 Hexa-cyclic compound DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1988-12-28 — — EP disclosed
Send feedback