SCHEMBL1923594

SCHEMBL1923594

CCCCOc1ccc(C(=O)Oc2ccc(/N=N/c3ccccc3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.68
ACR P10323 1/20 0.68
LMNA P02545 4/20 0.58
NPC1 O15118 3/20 0.58
CYP1A2 P05177 2/20 0.58
CYP2C9 P11712 2/20 0.58
CYP2C19 P33261 2/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2D6 P10635 1/20 0.58
KMT2A Q03164 2/20 0.57
MAPT P10636 4/20 0.56
NFKB1 P19838 3/20 0.56
NFKB2 Q00653 3/20 0.56
RELA Q04206 3/20 0.56
PPARA Q07869 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 2/20 0.55
RAB9A P51151 2/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54

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
SCHEMBL26602060 0.90 PRSS1 (0.70) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL5706230 0.89 KMT2A (0.70) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL30030754 0.87 LMNA (0.69) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL1923591 0.86 PRSS1 (0.52) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL9829760 0.86 NPC1 (0.72) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL19930172 0.86 PRSS1 (0.64) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL14130027 0.85 MAPT (0.66) PRSS1ACRKMT2AMAPTRAB9A
SCHEMBL11646532 0.85 LMNA (0.74) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL27740551 0.85 LMNA (0.74) PRSS1ACRLMNANPC1CYP1A2
SCHEMBL27279499 0.85 MAPT (0.66) PRSS1ACRKMT2AMAPTRAB9A

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-2328541-A1 A STIMULATABLE ASYMMETRICAL POLYMERSOME Institut Curie (FR) 2011-06-08 EP claimed