SCHEMBL10941972

SCHEMBL10941972

Clc1ccccc1-c1nc(-c2ccccc2Cl)n(CCc2ccccc2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H3 Q13133 3/20 0.46
▸ NR1H2 P55055 2/20 0.46
▸ ALDH1A1 P00352 5/20 0.45
▸ LMNA P02545 5/20 0.45
▸ USP2 O75604 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ GAA P10253 2/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43
▸ EGFR P00533 2/20 0.42
▸ TUBB4A P04350 2/20 0.42
▸ TUBB P07437 2/20 0.42
▸ TUBA3C P0DPH7 2/20 0.42
▸ TUBA1B P68363 2/20 0.42
▸ TUBA4A P68366 2/20 0.42

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
SCHEMBL10942439 0.87 NR1H3 (0.58) NR1H3NR1H2ALDH1A1LMNAUSP2
SCHEMBL10944048 0.79 NR1H3 (0.52) NR1H3NR1H2ALDH1A1LMNAHPGD
SCHEMBL10940616 0.75 ATM (0.44) NR1H3NR1H2ALDH1A1LMNAHPGD
SCHEMBL8304887 0.73 HSD11B1 (0.55) NR1H3NR1H2ALDH1A1LMNAMAPT
SCHEMBL9831268 0.73 HSD11B1 (0.54) EGFRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL29411966 0.71 KDM4E (0.56) ALDH1A1LMNAMAPTHPGDPOLB
SCHEMBL28493341 0.71 KDM4E (0.56) ALDH1A1LMNAMAPTHPGDPOLB
SCHEMBL9831536 0.71 HSD11B1 (0.55) NR1H3ALDH1A1HSD17B10EGFRTUBB4A
SCHEMBL9832147 0.71 HSD11B1 (0.52) EGFRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL9830317 0.71 HSD11B1 (0.55) EGFRTUBB4ATUBBTUBA3CTUBA1B

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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