SCHEMBL10940616

SCHEMBL10940616

C=CCn1nc(-c2ccccc2Cl)nc1-c1ccccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.44
▸ EGFR P00533 2/20 0.40
▸ TUBB4A P04350 2/20 0.40
▸ TUBB P07437 2/20 0.40
▸ TUBA3C P0DPH7 2/20 0.40
▸ TUBA1B P68363 2/20 0.40
▸ TUBA4A P68366 2/20 0.40
▸ TUBB4B P68371 2/20 0.40
▸ TUBB3 Q13509 2/20 0.40
▸ TUBB2A Q13885 2/20 0.40
▸ TUBB8 Q3ZCM7 2/20 0.40
▸ TUBA3E Q6PEY2 2/20 0.40
▸ TUBA1A Q71U36 2/20 0.40
▸ TUBA1C Q9BQE3 2/20 0.40
▸ TUBB6 Q9BUF5 2/20 0.40
▸ TUBB2B Q9BVA1 2/20 0.40
▸ TUBB1 Q9H4B7 2/20 0.40
▸ LMNA P02545 6/20 0.40
▸ ALDH1A1 P00352 5/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40

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
SCHEMBL9829202 0.87 HSD11B1 (0.48) ATMEGFRTUBB4ATUBBTUBA3C
SCHEMBL9829494 0.87 HSD11B1 (0.48) ATMLMNAALDH1A1L3MBTL1POLB
SCHEMBL10944048 0.80 NR1H3 (0.52) EGFRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10942439 0.79 NR1H3 (0.58) EGFRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10941972 0.75 NR1H3 (0.46) EGFRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10947181 0.73 HSD11B1 (0.53) LMNAALDH1A1L3MBTL1POLBHSD11B1
SCHEMBL11366141 0.72 ATM (0.42) ATMEGFRTUBB4ATUBBTUBA3C
SCHEMBL8304887 0.71 HSD11B1 (0.55) EGFRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL9830794 0.70 HSD11B1 (0.53) EGFRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL30581249 0.70 KDM4E (0.60) ATMLMNAALDH1A1L3MBTL1POLB

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 5 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 claimed
EP-0036711-A2 Pesticidal heterocyclic compounds, processes for preparing them, compositions containing them, and their use FBC LIMITED (GB) 1981-09-30 — — EP claimed
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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