SCHEMBL31061298

SCHEMBL31061298

O=C1Nc2ccc(C(=O)CCl)cc2/C1=C/c1ccc[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NEK2 P51955 2/20 1.00
CDK1 P06493 1/20 1.00
CCNB1 P14635 1/20 1.00
TLK2 Q86UE8 6/20 0.76
PDPK1 O15530 6/20 0.74
JAK3 P52333 4/20 0.74
PAK4 O96013 2/20 0.70
NTRK1 P04629 1/20 0.66
PDGFRB P09619 2/20 0.65
PDGFRA P16234 1/20 0.65
FLT1 P17948 1/20 0.65
KDR P35968 1/20 0.65
RET P07949 2/20 0.61
FLT3 P36888 1/20 0.61
ALK Q9UM73 1/20 0.61

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
SCHEMBL12200908 1.00 NEK2 (1.00) NEK2CDK1CCNB1TLK2PDPK1
SCHEMBL20945 0.85 TLK2 (1.00) NEK2CDK1CCNB1TLK2PDPK1
SCHEMBL20944 0.85 TLK2 (1.00) NEK2CDK1CCNB1TLK2PDPK1
SCHEMBL5728434 0.84 PDPK1 (1.00) NEK2CDK1CCNB1TLK2PDPK1
SCHEMBL13080513 0.84 TLK2 (1.00) NEK2CDK1CCNB1TLK2PDPK1
SCHEMBL5728440 0.84 PDPK1 (1.00) NEK2CDK1CCNB1TLK2PDPK1
SCHEMBL5361523 0.81 PDPK1 (1.00) NEK2CDK1CCNB1TLK2PDPK1
SCHEMBL5728671 0.81 PDPK1 (1.00) NEK2CDK1CCNB1TLK2PDPK1
SCHEMBL5366002 0.81 PDPK1 (0.80) NEK2CDK1CCNB1TLK2PDPK1
SCHEMBL5374151 0.81 PDPK1 (0.78) NEK2CDK1CCNB1TLK2PDPK1

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-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 EP disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 WO disclosed