SCHEMBL7982082

SCHEMBL7982082

CNCCC1CCC(N)CC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.42
MAPT P10636 1/20 0.33
KMT5A Q9NQR1 1/20 0.32
CARM1 Q86X55 2/20 0.31
PRMT6 Q96LA8 2/20 0.31
PRMT3 O60678 1/20 0.31
PRMT1 Q99873 1/20 0.30
PRMT8 Q9NR22 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
SCHEMBL919372 0.87
SCHEMBL17919936 0.87 SIGMAR1 (0.50) SIGMAR1MAPTCARM1PRMT6PRMT3
Hydrochloric Acid SCHEMBL14744246 0.85
SCHEMBL26528390 0.81 SIGMAR1 (0.42) SIGMAR1MAPTCARM1PRMT6PRMT1
SCHEMBL21675732 0.81 SIGMAR1 (0.42) SIGMAR1MAPTCARM1PRMT6PRMT1
SCHEMBL25927003 0.78 CARM1 (0.45) SIGMAR1MAPTCARM1PRMT6PRMT1
SCHEMBL21675740 0.78 SIGMAR1 (0.43) SIGMAR1MAPTCARM1PRMT6PRMT1
SCHEMBL17919937 0.78 SIGMAR1 (0.48) SIGMAR1MAPTCARM1PRMT6PRMT1
SCHEMBL1680312 0.77
SCHEMBL919693 0.77

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
WO-2022159454-A1 BET SUBFAMILY INHIBITORS AND METHODS USING SAME BAYLOR COLLEGE OF MEDICINE (US) 2022-07-28 WO disclosed
EP-3693022-A2 COX-2-TARGETING, PLATINUM-CONTAINING CONJUGATES AND THEIR USE IN THE TREATMENT OF TUMORS AND CANCERS Reiley Pharmaceuticals, Inc. (US) 2020-08-12 EP disclosed
WO-2010006267-A2 CYCLIC TETRAPEPTIDES UNIVERSITY OF KANSAS (US) 2010-01-14 WO disclosed