SCHEMBL11099215

SCHEMBL11099215

CC1=NC=CCC1=Nc1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MAPK1 P28482 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL14086384 0.64 ALDH1A1 (0.48) LMNAPOLBSMN1; SMN2MAPK1HTT
SCHEMBL18786507 0.64 ALDH1A1 (0.45) LMNAPOLBSMN1; SMN2HTT
SCHEMBL7866209 0.62 CYP2D6 (0.34) LMNAPOLBSMN1; SMN2MAPK1
SCHEMBL9615422 0.62 LMNA (0.33) LMNAPOLBSMN1; SMN2MAPK1HTT
SCHEMBL8773370 0.59 FURIN (0.43) LMNAPOLBSMN1; SMN2MAPK1HTT
SCHEMBL19386537 0.59 — —
SCHEMBL8773373 0.59 FURIN (0.43) LMNAPOLBSMN1; SMN2MAPK1HTT
SCHEMBL2430394 0.58 CHRNB4 (0.39) LMNASMN1; SMN2MAPK1
SCHEMBL10039078 0.57 NPC1 (0.39) SMN1; SMN2HTT
SCHEMBL33542 0.57 — —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0033183-B1 PHENYLIMINOMETHYL-3-PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1984-07-04 — — EP disclosed
EP-0033183-A2 Phenyliminomethyl-3-pyridine derivatives, their preparation and use SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1981-08-05 — — EP disclosed
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