SCHEMBL7130537

SCHEMBL7130537

CNS(=O)(=O)c1ccc2c(c1)C(=Cc1cc(C)ccc1C)C(=O)N2

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
SRC P12931 11/20 0.55
NTRK1 P04629 1/20 0.55
FCER2 P06734 1/20 0.55
SYK P43405 1/20 0.55
NTRK3 Q16288 1/20 0.55
NTRK2 Q16620 1/20 0.55
CDK2 P24941 2/20 0.53
KDR P35968 8/20 0.52
PDGFRB P09619 7/20 0.50
LCK P06239 7/20 0.50
FYN P06241 7/20 0.50
YES1 P07947 7/20 0.50
FGFR1 P11362 7/20 0.50
RET P07949 2/20 0.48
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
PDPK1 O15530 1/20 0.46
AURKA O14965 1/20 0.45

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
SCHEMBL7132020 0.91 MEN1 (0.58) MEN1KMT2ASRCNTRK1FCER2
SCHEMBL7138258 0.87 MEN1 (0.66) MEN1KMT2ASRCNTRK1FCER2
SCHEMBL7136883 0.85 SRC (0.58) SRCNTRK1FCER2SYKNTRK3
SCHEMBL5362316 0.82 SYK (0.60) SRCNTRK1FCER2SYKNTRK3
SCHEMBL7133214 0.82 MOGAT2 (0.56) MEN1KMT2ASYKPDGFRBRET
SCHEMBL5361802 0.81 SRC (0.54) MEN1KMT2ASRCNTRK1FCER2
SCHEMBL7132924 0.80 NPC1 (0.60) MEN1KMT2ASRCNTRK1FCER2
SCHEMBL5361428 0.80 LRRK2 (0.64) SRCNTRK1FCER2SYKNTRK3
SCHEMBL30453667 0.80 PDPK1 (0.64) SRCNTRK1FCER2SYKNTRK3
SCHEMBL5365048 0.80 RET (0.67) MEN1KMT2ASRCNTRK1SYK

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
US-6506763-B2 Useful in prevention and treatment of protein kinase related disorders such as cancer SUGEN, INC. 2003-01-14 US disclosed
US-6133305-A PREVENTION AND TREATMENT OF PROTEIN KINASE RELATED DISORDERS SUCH AS CANCER SUGEN, INC. (US) 2000-10-17 US disclosed