SCHEMBL9069997

SCHEMBL9069997

CSc1ccc(C(=O)c2cnoc2C2CC2)c(C)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
CASP3 P42574 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
DHODH Q02127 3/20 0.34
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
TAS1R2 Q8TE23 1/20 0.34
PDE2A O00408 1/20 0.34
CRACR2A Q9BSW2 2/20 0.32
NPC1 O15118 1/20 0.31
SMURF2 Q9HAU4 1/20 0.31
SMURF1 Q9HCE7 1/20 0.31
LMNA P02545 1/20 0.31
ALOX15 P16050 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
SCHEMBL9069970 0.89 DHODH (0.36) RAB9AALDH1A1HPGDCASP3SMN1; SMN2
SCHEMBL8489274 0.85 DHODH (0.35) RAB9AALDH1A1HPGDCASP3SMN1; SMN2
SCHEMBL7572968 0.84 ALDH1A1 (0.34) RAB9AALDH1A1HPGDCASP3SMN1; SMN2
SCHEMBL9070501 0.84 TUBB4A (0.36) DHODHTAS1R3TAS1R1TAS1R2PDE2A
SCHEMBL8492364 0.83 HPGD (0.37) RAB9AALDH1A1HPGDCASP3SMN1; SMN2
SCHEMBL7555059 0.83 HPGD (0.35) RAB9AALDH1A1HPGDCASP3SMN1; SMN2
SCHEMBL8493087 0.82 DHODH (0.43) RAB9AALDH1A1HPGDCASP3SMN1; SMN2
SCHEMBL7575688 0.82 ALDH1A1 (0.34) RAB9AALDH1A1HPGDCASP3SMN1; SMN2
SCHEMBL7575732 0.82 ALDH1A1 (0.32) RAB9AALDH1A1HPGDCASP3SMN1; SMN2
SCHEMBL8492889 0.81 PDE2A (0.36) RAB9AALDH1A1HPGDCASP3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0527037-B1 4-Benzoylisoxazole derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1996-10-16 EP claimed
EP-0527037-A1 4-Benzoylisoxazole derivatives and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1993-02-10 EP claimed
EP-0527037-B1 4-Benzoylisoxazole derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1996-10-16 EP disclosed
EP-0527037-A1 4-Benzoylisoxazole derivatives and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1993-02-10 EP disclosed