SCHEMBL6852286

SCHEMBL6852286

Cc1[c]cccc1-c1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ PLA2G7 Q13093 1/20 0.43
▸ HSD11B1 P28845 4/20 0.42
▸ CYP2A6 P11509 1/20 0.41
▸ DPP4 P27487 1/20 0.39
▸ LMNA P02545 3/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ TP53 P04637 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ PTPRC P08575 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ NOTUM Q6P988 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ MGAM O43451 1/20 0.33

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
SCHEMBL22115865 0.84 — —
SCHEMBL4431124 0.81 ELANE (0.36) KMT2APLA2G7HSD11B1NPC1RAB9A
SCHEMBL4608929 0.81 PTPN1 (0.38) KMT2AALDH1A1TP53HPGDIDO1
SCHEMBL7455214 0.80 POLB (0.41) KMT2APOLBPLA2G7HSD11B1CYP2A6
SCHEMBL157733 0.80 — —
SCHEMBL6709412 0.79 CYP2A6 (0.41) KMT2APOLBPLA2G7HSD11B1CYP2A6
SCHEMBL100932 0.78 TSHR (0.39) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL456349 0.78 CYP2A6 (0.44) KMT2APOLBPLA2G7HSD11B1CYP2A6
SCHEMBL5868331 0.78 HSD11B1 (0.48) KMT2AHSD11B1GAA
SCHEMBL4428493 0.78 GABRA1 (0.34) KMT2APLA2G7HSD11B1SMN1; SMN2ALDH1A1

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-0799827-B1 ACRYLAMIDE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME KYORIN SEIYAKU KK (JP) 2004-05-12 — — EP claimed
EP-2903440-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES Bayer CropScience AG (DE) 2015-08-12 — — EP disclosed
WO-2014053450-A1 HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2014-04-10 — — WO disclosed
EP-0133310-B1 IMIDAZOLIDINONES, AND IMIDAZOLIDINETHIONES, PROCESS FOR THE PREPARATION THEREOF, AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS AMERICAN CYANAMID COMPANY (US) 1988-09-14 — — EP disclosed
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