SCHEMBL11296059

SCHEMBL11296059

OC(CCl)CN1CCNCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ RAD52 P43351 1/20 0.46
▸ BAX Q07812 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ IDO1 P14902 1/20 0.41
▸ ATM Q13315 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ SLC6A2 P23975 2/20 0.36
▸ SLC6A4 P31645 2/20 0.36
▸ SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL11438133 0.86 SMN1; SMN2 (0.60) SMN1; SMN2RAD52BAXMEN1KMT2A
SCHEMBL151400 0.84 SMN1; SMN2 (0.58) SMN1; SMN2RAD52BAXMEN1KMT2A
SCHEMBL8391173 0.84 MEN1 (0.52) SMN1; SMN2MEN1KMT2AMAPTPOLB
SCHEMBL9819626 0.84 MEN1 (0.52) SMN1; SMN2MEN1KMT2AMAPTPOLB
SCHEMBL16908299 0.80 MAPT (0.64) SMN1; SMN2RAD52BAXMEN1KMT2A
SCHEMBL4400918 0.80 MAPT (0.64) SMN1; SMN2RAD52BAXMEN1KMT2A
SCHEMBL1361161 0.80 MAPT (0.64) SMN1; SMN2RAD52BAXMEN1KMT2A
SCHEMBL488808 0.79 MEN1 (0.68) SMN1; SMN2RAD52MEN1KMT2AMAPT
SCHEMBL24319375 0.78 SMN1; SMN2 (0.58) SMN1; SMN2RAD52BAXMEN1KMT2A
SCHEMBL2800007 0.78 SMN1; SMN2 (0.58) SMN1; SMN2RAD52BAXMEN1KMT2A

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-3645605-A1 NOVEL POLYAMINES, SYNTHESIS METHOD THEREOF AND USE THEREOF FOR THE SELECTIVE ELEMINATION OF H2S FROM A GASEOUS EFFLUENT COMPRISING C02 IFP Energies nouvelles (FR) 2020-05-06 — — EP disclosed
US-4314807-A CATIONIC POLYMER, ANIONIC SURFACTANT SHAMPOO L'OREAL (FR) 1982-02-09 — — US disclosed
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