SCHEMBL11346556

SCHEMBL11346556

Cc1cc2c(cc1C#N)nnn2O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.35
▸ MGAM O43451 3/20 0.34
▸ AMY1A P0DUB6 3/20 0.34
▸ GAA P10253 3/20 0.34
▸ SI P14410 3/20 0.34
▸ MGAM2 Q2M2H8 3/20 0.34
▸ CTNNB1 P35222 4/20 0.32
▸ KDM1A O60341 3/20 0.32
▸ CSNK1D P48730 1/20 0.32
▸ CSNK1G2 P78368 1/20 0.32
▸ TCF7L2 Q9NQB0 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ USP2 O75604 1/20 0.31

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
SCHEMBL3278603 0.80 MGAM (0.47) PKMMAPK1POLBATMALDH1A1
SCHEMBL3283322 0.74 MGAM (0.42) PKMMAPK1POLBATMALDH1A1
SCHEMBL6268160 0.71 MGAM (0.43) PKMMAPK1POLBATMALDH1A1
SCHEMBL3285969 0.70 MGAM (0.42) PKMMAPK1POLBATMALDH1A1
SCHEMBL119203 0.66 TSHR (0.50) POLBALDH1A1CSNK1DCSNK1G2USP2
SCHEMBL3278850 0.66 MAPK1 (0.53) PKMMAPK1POLBATMALDH1A1
SCHEMBL3279838 0.66 PKM (0.56) PKMMAPK1POLBATMALDH1A1
SCHEMBL3286306 0.65 GAA (0.47) PKMMAPK1POLBATMALDH1A1
SCHEMBL30888289 0.65 GAA (0.45) PKMMAPK1POLBATMALDH1A1
SCHEMBL3286540 0.65 POLB (0.42) PKMMAPK1POLBATMALDH1A1

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
EP-0002774-B1 PROCESS FOR ACYLATING 7AMINOCEPHEM DERIVATIVES HOECHST AKTIENGESELLSCHAFT (DE) 1981-09-23 — — EP disclosed
EP-0002774-A1 Process for acylating 7aminocephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1979-07-11 — — EP disclosed
Send feedback