SCHEMBL9206228

SCHEMBL9206228

Cc1ccc2c(O)c(C(=O)Nc3nnc(C(F)(F)F)s3)c(=O)oc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.53
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ MAPT P10636 2/20 0.52
▸ HPGD P15428 1/20 0.52
▸ NPC1 O15118 7/20 0.52
▸ RAB9A P51151 6/20 0.52
▸ HTT P42858 5/20 0.52
▸ LMNA P02545 2/20 0.48
▸ CYP2C9 P11712 1/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ GAA P10253 1/20 0.44
▸ TP53 P04637 2/20 0.44
▸ PRNP P04156 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43
▸ TAS1R3 Q7RTX0 1/20 0.43

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
SCHEMBL7610155 0.89 MEN1 (0.56) POLBMEN1KMT2AMAPTHPGD
SCHEMBL7617104 0.89 KMT2A (0.53) POLBMEN1KMT2AMAPTHPGD
SCHEMBL7618641 0.88 MEN1 (0.52) POLBMEN1KMT2AMAPTHPGD
SCHEMBL9201286 0.87 NPC1 (0.57) POLBMEN1KMT2AMAPTHPGD
SCHEMBL9207130 0.86 MEN1 (0.53) POLBMEN1KMT2AMAPTHPGD
SCHEMBL9208153 0.85 NPC1 (0.64) POLBMEN1KMT2AMAPTHPGD
SCHEMBL7610711 0.83 MEN1 (0.49) POLBMEN1KMT2AMAPTHPGD
SCHEMBL7610344 0.83 MEN1 (0.56) MEN1KMT2AMAPTHPGDNPC1
SCHEMBL7608938 0.82 KMT2A (0.45) POLBMEN1KMT2AMAPTHPGD
SCHEMBL7620367 0.82 KMT2A (0.45) POLBMEN1KMT2AMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0550493-B1 ANTHELMINTIC AND ANTICOCCIDAL 3-CARBAMOYL-4-HYDROXYCOUMARINS, METHOD OF USE AND COMPOSITIONS UPJOHN CO (US) 1995-08-09 — — EP claimed
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