SCHEMBL9523939

SCHEMBL9523939

CN(C(=O)c1nnc2ccccc2c1O)C1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
NPC1 O15118 6/20 0.46
RAB9A P51151 6/20 0.46
POLB P06746 1/20 0.44
ATM Q13315 2/20 0.43
PTAFR P25105 1/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
BACE1 P56817 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
MITF O75030 1/20 0.40
PKM P14618 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
SCHEMBL6991183 0.77 HPGD (0.51) HPGDTSHRL3MBTL1NPC1RAB9A
SCHEMBL3085598 0.76 HSP90AA1 (0.47) HPGDTSHRL3MBTL1NPC1RAB9A
SCHEMBL9524674 0.74 KMT2A (0.45) HPGDPOLBMAPTSMN1; SMN2MEN1
SCHEMBL9523856 0.74 HIF1A (0.55) HPGDNPC1RAB9APOLBALDH1A1
SCHEMBL9524896 0.74 HIF1A (0.55) HPGDNPC1RAB9APOLBALDH1A1
SCHEMBL9525627 0.72 LCK (0.40) MEN1KMT2AHTT
SCHEMBL9527969 0.72 RAB9A (0.54) HPGDNPC1RAB9APOLBALDH1A1
SCHEMBL9001760 0.71 TSHR (0.79) HPGDTSHRNPC1RAB9APOLB
SCHEMBL9527463 0.70 LCK (0.38) TSHRNPC1RAB9APOLBMEN1
SCHEMBL9523543 0.70 MEN1 (0.44) HPGDTSHRL3MBTL1NPC1RAB9A

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
EP-0277791-B1 CINNOLINE-CARBOXAMIDES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1993-06-02 EP disclosed
US-4826837-A IMMUNOMODULATORS FARMITALIA CARLO ERBA S.R.L. (IT) 1989-05-02 US disclosed
EP-0277791-A2 Cinnoline-carboxamides and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1988-08-10 EP disclosed