SCHEMBL10947181

SCHEMBL10947181

C=CCn1c(-c2ccccc2Cl)nnc1-c1ccccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 9/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ LMNA P02545 3/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ KDM4E B2RXH2 3/20 0.43
▸ HPGD P15428 2/20 0.43
▸ TDP1 Q9NUW8 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PDE2A O00408 1/20 0.39
▸ PDE10A Q9Y233 1/20 0.39

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
SCHEMBL30581249 0.79 KDM4E (0.60) ALDH1A1LMNARAB9ASMN1; SMN2KDM4E
SCHEMBL29076186 0.79 KDM4E (0.60) ALDH1A1LMNARAB9ASMN1; SMN2KDM4E
SCHEMBL10940832 0.77 HSD11B1 (0.63) HSD11B1ALDH1A1LMNANPC1RAB9A
SCHEMBL10939819 0.74 HSD11B1 (0.65) HSD11B1ALDH1A1LMNANPC1RAB9A
SCHEMBL10940616 0.73 ATM (0.44) HSD11B1ALDH1A1LMNANPC1RAB9A
SCHEMBL4215779 0.72 HSD11B1 (0.50) HSD11B1ALDH1A1LMNANPC1RAB9A
SCHEMBL10945027 0.70 HSD11B1 (0.58) HSD11B1ALDH1A1LMNARAB9ASMN1; SMN2
SCHEMBL19549118 0.70 HSD11B1 (0.54) HSD11B1ALDH1A1LMNANPC1RAB9A
SCHEMBL10940862 0.70 ALDH1A1 (1.00) HSD11B1ALDH1A1LMNANPC1RAB9A
SCHEMBL2747473 0.70 HSD11B1 (1.00) HSD11B1ALDH1A1LMNANPC1RAB9A

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-0036711-B1 PESTICIDAL HETEROCYCLIC COMPOUNDS, PROCESSES FOR PREPARING THEM, COMPOSITIONS CONTAINING THEM, AND THEIR USE FBC LIMITED (GB) 1985-12-04 — — EP disclosed
US-4414221-A MITICIDES, INSECTICIDES, APHIDICIDES FBC LIMITED (GB) 1983-11-08 — — US disclosed
EP-0036711-A2 Pesticidal heterocyclic compounds, processes for preparing them, compositions containing them, and their use FBC LIMITED (GB) 1981-09-30 — — EP disclosed
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