SCHEMBL9324082

SCHEMBL9324082

CSc1nc(N)nc(NC(C)CSc2cc(C)cc(C)c2)n1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 2/20 0.36
HSP90AA1 P07900 5/20 0.35
MAPK1 P28482 1/20 0.34
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HEXA P06865 1/20 0.30
HEXB P07686 1/20 0.30
TERT O14746 1/20 0.30

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
SCHEMBL10555756 0.86 HSP90AA1 (0.33) HSP90AA1
SCHEMBL9326246 0.84 GAA (0.35) GAA
SCHEMBL9326258 0.82 LMNA (0.36) HSP90AB1HSP90AA1LMNAGAAMAPT
SCHEMBL9325338 0.78 ATM (0.39) HSP90AA1LMNAGAAMAPT
SCHEMBL10550507 0.78 HSP90AA1 (0.44) HSP90AB1HSP90AA1LMNAMAPTSMN1; SMN2
SCHEMBL2106591 0.71 MAPK1 (0.53) HSP90AB1HSP90AA1MAPK1LMNAGAA
SCHEMBL10552305 0.71 KMT2A (0.37) HSP90AB1HSP90AA1LMNAGAAMAPT
SCHEMBL10554973 0.71 LMNA (0.42) MAPK1LMNAGAAMAPTSMN1; SMN2
SCHEMBL10559738 0.70 MAPT (0.46) HSP90AA1LMNAGAAMAPTSMN1; SMN2
SCHEMBL10554797 0.70 HSP90AB1 (0.34) HSP90AB1HSP90AA1LMNAGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0273328-B1 Triazine derivatives and herbicides containing said derivatives IDEMITSU KOSAN CO (JP) 1994-03-09 EP disclosed
US-4844731-A HERBICIDES FOR RICE PADDYS IDEMITSU COMPANY CO., LTD. (JP) 1989-07-04 US disclosed
EP-0273328-A2 Triazine derivatives and herbicides containing said derivatives IDEMITSU KOSAN COMPANY LIMITED (JP) 1988-07-06 EP disclosed