SCHEMBL17079057

SCHEMBL17079057

C#Cc1ccc2c(ccn2CC2CCNCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 19/20 0.47

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
SCHEMBL6998824 0.81 KDM1A (0.59) KDM1A
SCHEMBL17063357 0.80 HTR2A (0.47) KDM1A
Hydrochloric Acid SCHEMBL7951984 0.80 KDM1A (0.58) KDM1A
SCHEMBL3135567 0.79 NPY5R (0.47) KDM1A
SCHEMBL4824315 0.78 KDM1A (0.54) KDM1A
Hydrochloric Acid SCHEMBL17063302 0.78 HTR2A (0.46) KDM1A
SCHEMBL4777232 0.77 HTR6 (0.52)
SCHEMBL17458540 0.76 POLB (0.45)
SCHEMBL17063332 0.75 KDM4E (0.44)
SCHEMBL22439463 0.74 CNR2 (0.52) KDM1A

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-3116504-A2 RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTOR MODULATORS AND USES THEREOF Innov17 LLC (US) 2017-01-18 EP disclosed
WO-2015138276-A2 RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTOR MODULATORS AND USES THEREOF INNOV17 LLC (US) 2015-09-17 WO disclosed