SCHEMBL20919675

SCHEMBL20919675

CNC(=O)c1cc(-c2ccc(C3(C(=O)Nc4cccnc4)CCC3)cc2)ccn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
HDAC1 Q13547 6/20 0.53
IDO1 P14902 3/20 0.49
LMNA P02545 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
PORCN Q9H237 1/20 0.41
HSD17B10 Q99714 1/20 0.41
BRAF P15056 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
GAA P10253 1/20 0.41
NAMPT P43490 1/20 0.41
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL20919699 0.83 IDO1 (0.42) ALDH1A1HDAC1IDO1LMNANPSR1
SCHEMBL20919670 0.83 HDAC1 (0.43) ALDH1A1HDAC1IDO1HDAC3HDAC7
SCHEMBL20919680 0.82 ALDH1A1 (0.60) ALDH1A1HDAC1IDO1LMNANPSR1
SCHEMBL9966266 0.82 ALDH1A1 (0.62) ALDH1A1HDAC1IDO1LMNANPSR1
SCHEMBL20919709 0.82 IDO1 (0.41) ALDH1A1HDAC1IDO1HDAC3HDAC7
SCHEMBL20919737 0.81 FFAR2 (0.43) ALDH1A1HDAC1IDO1LMNAHDAC3
SCHEMBL20919702 0.80 FFAR2 (0.44) ALDH1A1HDAC1IDO1LMNA
SCHEMBL20919682 0.80 HDAC1 (0.44) ALDH1A1HDAC1IDO1HDAC3HDAC7
SCHEMBL20938113 0.80 HDAC1 (0.44) ALDH1A1HDAC1IDO1HDAC3HDAC7
SCHEMBL20919674 0.80 IDO1 (0.40) ALDH1A1HDAC1IDO1HDAC3HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3735410-A1 PICOLINAMIDE COMPOUNDS Tempest Therapeutics, Inc. (US) 2020-11-11 EP claimed
WO-2019079614-A1 PICOLINAMIDE COMPOUNDS TEMPEST THERAPEUTICS, INC. (US) 2019-04-25 WO claimed
EP-3735410-A1 PICOLINAMIDE COMPOUNDS Tempest Therapeutics, Inc. (US) 2020-11-11 EP disclosed
WO-2019079614-A1 PICOLINAMIDE COMPOUNDS TEMPEST THERAPEUTICS, INC. (US) 2019-04-25 WO disclosed
WO-2019079614-A1 PICOLINAMIDE COMPOUNDS TEMPEST THERAPEUTICS, INC. (US) 2019-04-25 WO disclosed