SCHEMBL7954562

SCHEMBL7954562

Cc1c[c]nc2c(Cl)cccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 6/20 0.41
PARP1 P09874 2/20 0.40
CYP1A2 P05177 3/20 0.38
CYP2A6 P11509 3/20 0.38
AR P10275 1/20 0.36
LMNA P02545 1/20 0.36
CRHR1 P34998 1/20 0.36
AURKA O14965 1/20 0.35
DAPK3 O43293 1/20 0.35
JAK2 O60674 1/20 0.35
PRKD3 O94806 1/20 0.35
MAP4K4 O95819 1/20 0.35
PAK4 O96013 1/20 0.35
ABL1 P00519 1/20 0.35
CSF1R P07333 1/20 0.35
RET P07949 1/20 0.35
IGF1R P08069 1/20 0.35
MET P08581 1/20 0.35
PDGFRB P09619 1/20 0.35
PIM1 P11309 1/20 0.35

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
SCHEMBL3861841 0.82 CYP2A6 (0.42) PARP1CYP1A2CYP2A6PSMD14COPS5
SCHEMBL7952608 0.78 AR (0.36) PARP1CYP1A2CYP2A6ARACHE
SCHEMBL7954070 0.75 NQO2 (0.42) LMNAKDM4EALDH1A1SMN1; SMN2
SCHEMBL5953588 0.75 ELANE (0.35) CYP1A2CYP2A6LMNAPSMD14COPS5
SCHEMBL3271557 0.69 PSMD14 (0.61) NR4A2PARP1CYP1A2CYP2A6AR
SCHEMBL411657 0.68 CYP1A2 (0.45) CYP1A2LMNAACHEKDM4EALDH1A1
SCHEMBL24652477 0.68 NR4A2 (0.42) NR4A2PARP1CYP1A2CYP2A6AR
SCHEMBL9830968 0.68 NR4A2 (0.69) NR4A2PARP1CYP1A2LMNACRHR1
SCHEMBL7452926 0.67 CCR1 (0.67) PSMD14COPS5ALDH1A1
SCHEMBL13106238 0.64 NR4A2 (0.42) NR4A2PARP1CYP1A2CYP2A6AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5378711-A α-arylacrylates substituted by a heterocyclic radical, and fungicides which contain these compounds BASF AKTIENGESELLSCHAFT (DE) 1995-01-03 US claimed
US-6211190-B1 Pyrimidine derivatives, process and intermediate products for their preparation and pesticides or fungicides containing these derivatives BASF AKTIENGESELLSCHAFT (DE) 2001-04-03 US disclosed
US-6200997-B1 CYCLIZATION TO GIVE OXAZOLIDINEDIONES AND TRIAZOLIDINEDIONES BASF AKTIENGESELLSCHAFT (DE) 2001-03-13 US disclosed
CN-1187814-A (hetero) aryloxy-, -thio-and-aminocrotonates, preparation and use thereof BASF AG (DE) 1998-07-15 CN disclosed
CN-1161687-A Phenylacetic acid alkyl esters BASF AG (DE) 1997-10-08 CN disclosed
US-5554578-A Oxime ether derivatives, their preparation and fungicides containing these derivatives BASF AKTIENGESELLSCHAFT (DE) 1996-09-10 US disclosed
US-5468717-A Oxime ether derivatives, their preparation and fungicides containing these derivatives BASF AKTIENGESELLSCHAFT (DE) 1995-11-21 US disclosed
US-5334577-A 2-(substituted pyridy-oxymethyl)-phenylglyoxylate alkyloxime BASF AKTIENGESELLSCHAFT (DE) 1994-08-02 US disclosed