SCHEMBL24840948

SCHEMBL24840948

Cc1cc2ccc(N(C)C)cc2o1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SLC16A3 O15427 1/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ APAF1 O14727 1/20 0.50
▸ USP2 O75604 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ APP P05067 9/20 0.46
▸ TERT O14746 1/20 0.45
▸ PGR P06401 4/20 0.44
▸ CYP19A1 P11511 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MAOB P27338 1/20 0.38
▸ EGFR P00533 1/20 0.38
▸ PDGFRA P16234 1/20 0.38
▸ KDR P35968 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
SCHEMBL24964449 0.84 DYRK1A (0.47) SLC16A3RAB9AAPPTERTPGR
SCHEMBL13810949 0.79 CYP19A1 (0.64) SLC16A3L3MBTL1USP2RAB9ATERT
SCHEMBL25842366 0.78 SLC16A3 (0.63) SLC16A3L3MBTL1APAF1USP2RAB9A
SCHEMBL21860450 0.78 MAOB (0.40) SLC16A3L3MBTL1USP2RAB9APGR
SCHEMBL30480281 0.74 KDM4E (0.67) SLC16A3L3MBTL1PGRALDH1A1KDM4E
SCHEMBL29007333 0.74 KDM4E (0.67) SLC16A3L3MBTL1PGRALDH1A1KDM4E
SCHEMBL214310 0.74 KDM4E (0.67) SLC16A3L3MBTL1PGRALDH1A1KDM4E
SCHEMBL11863201 0.74 CYP2A6 (0.53) SLC16A3L3MBTL1APAF1USP2RAB9A
SCHEMBL24999943 0.74 CYP2A6 (0.53) SLC16A3L3MBTL1APAF1USP2RAB9A
SCHEMBL26009207 0.74 APP (0.56) SLC16A3L3MBTL1APAF1USP2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023275337-A1 INHIBITORS OF TRANSGLUTAMINASES ZEDIRA GMBH (DE) 2023-01-05 — — WO disclosed
Send feedback