SCHEMBL9523716

SCHEMBL9523716

O=C(Nc1cccc(F)c1)c1nnc2c(Cl)cccc2c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.46
HPGD P15428 3/20 0.46
NPC1 O15118 2/20 0.46
TSHR P16473 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
LMNA P02545 3/20 0.46
MAPK1 P28482 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
ESRRG P62508 1/20 0.43
MAPT P10636 1/20 0.43
KDM4E B2RXH2 2/20 0.42
RXFP1 Q9HBX9 1/20 0.42
POLB P06746 2/20 0.42
ALDH1A1 P00352 1/20 0.42
GLA P06280 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
SCHEMBL9524359 0.88 MEN1 (0.49) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL9524579 0.88 HIF1A (0.54) RAB9AHPGDNPC1TSHRMEN1
SCHEMBL9527884 0.86 POLB (0.45) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL9525781 0.86 FLT3 (0.51) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL9527182 0.81 NPC1 (0.52) RAB9AHPGDNPC1TSHRMEN1
SCHEMBL9525061 0.81 RAB9A (0.51) RAB9AHPGDNPC1TSHRMEN1
SCHEMBL9523580 0.79 NPC1 (0.49) RAB9AHPGDNPC1TSHRMEN1
SCHEMBL9524703 0.77 GPR27 (0.46) RAB9AHPGDNPC1MEN1KMT2A
SCHEMBL9524788 0.75 KCNK3 (0.49) RAB9AHPGDNPC1TSHRMEN1
SCHEMBL9525519 0.75 FADS1 (0.52) RAB9ANPC1MEN1KMT2ASMN1; SMN2

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