SCHEMBL9527401

SCHEMBL9527401

CCCCNC(=O)c1nnc2ccccc2c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
HPGD P15428 2/20 0.46
ALDH1A1 P00352 2/20 0.45
NAAA Q02083 2/20 0.45
USP2 O75604 1/20 0.44
GABRG2 P18507 3/20 0.43
GABRB3 P28472 3/20 0.43
GABRA2 P47869 3/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
PRNP P04156 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
BCL2 P10415 1/20 0.42

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
SCHEMBL9525892 0.95 NAAA (0.52) TSHRHTTSMN1; SMN2NPC1RAB9A
SCHEMBL9525682 0.95 NAAA (0.52) TSHRHTTSMN1; SMN2NPC1RAB9A
SCHEMBL9524829 0.86 HTT (0.56) HTTNPC1RAB9AHPGDALDH1A1
SCHEMBL9525642 0.83 KDM4E (0.51) TSHRHTTSMN1; SMN2NPC1RAB9A
SCHEMBL9524590 0.83 RAD52 (0.49) HTTSMN1; SMN2HPGDALDH1A1MAPK1
SCHEMBL9523732 0.81 RAB9A (0.55) TSHRHTTSMN1; SMN2NPC1RAB9A
SCHEMBL821644 0.79 EGLN1 (0.62)
SCHEMBL31372088 0.79 EGLN1 (0.62)
SCHEMBL9527944 0.79 NSD2 (0.50) ALDH1A1MAPTRXFP1KDM4E
SCHEMBL9524773 0.78 NCEH1 (0.49) ALDH1A1

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-0277791-B1 CINNOLINE-CARBOXAMIDES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1993-06-02 EP claimed
EP-0277791-A2 Cinnoline-carboxamides and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1988-08-10 EP claimed
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