SCHEMBL11050940

SCHEMBL11050940

C=CCN(CC=C)C(C)N1CCOCC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.33
MAPT P10636 2/20 0.32
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL8991775 0.72 USP2 (0.36) KMT2AMAPTALDH1A1LMNAHPGD
SCHEMBL170764 0.71 KMT2A (0.38) KMT2AMAPTALDH1A1LMNAHPGD
SCHEMBL809036 0.69 MAPT (0.36) KMT2AMAPTALDH1A1LMNAHPGD
SCHEMBL24722902 0.69 MAPT (0.36) KMT2AMAPTALDH1A1LMNAHPGD
SCHEMBL7072697 0.67 RAB9A (0.36) KMT2AALDH1A1LMNARAB9A
SCHEMBL5682733 0.66 MAPT (0.36) KMT2AMAPTRAB9A
SCHEMBL1363734 0.64
SCHEMBL1477384 0.63 KMT2A (0.41) KMT2AMAPTALDH1A1LMNAHPGD
SCHEMBL300143 0.63 KMT2A (0.41) KMT2AMAPTALDH1A1LMNAHPGD
SCHEMBL3191016 0.63 RAB9A (0.35) KMT2AMAPTALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4501873-A USING BASIC CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1985-02-26 US disclosed