SCHEMBL9849437

SCHEMBL9849437

Cc1ccc2ccc(O)nc2n1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.44
RAB9A P51151 1/20 0.44
CCR5 P51681 1/20 0.44
METAP2 P50579 1/20 0.42
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 3/20 0.38
KMT2A Q03164 2/20 0.36
OPRK1 P41145 1/20 0.36
GAA P10253 1/20 0.35
USP2 O75604 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL12910406 0.84 PTPN22 (0.31)
SCHEMBL7509409 0.84 CCR1 (0.58) CCR1RAB9ACCR5METAP2KDM4E
SCHEMBL25233688 0.73 CYP1A2 (0.46) CCR1RAB9ACCR5METAP2KDM4E
SCHEMBL19001477 0.71 CCR1 (0.44) CCR1RAB9ACCR5METAP2KDM4E
SCHEMBL22337665 0.71 CRHBP (0.30)
SCHEMBL30546638 0.71 NCF1 (0.42) RAB9AKDM4EALDH1A1CYP1A2KMT2A
SCHEMBL9849288 0.71 CCR1 (0.44) CCR1RAB9ACCR5KDM4EALDH1A1
SCHEMBL3586094 0.71 NCF1 (0.42) RAB9AKDM4EALDH1A1CYP1A2KMT2A
SCHEMBL2901701 0.71 NOS2 (0.50) CCR1RAB9ACCR5KDM4ECYP1A2
SCHEMBL22804140 0.70 ADORA1 (0.40)

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
US-4169092-A Transition metal-naphthyridine chemical complexes BAYER JOHN W 1979-09-25 US claimed
WO-2023176466-A1 VIRUS DETECTION METHOD 国立大学法人九州工業大学 2023-09-21 WO disclosed
CN-105646487-A Bromo-1,8-naphthyridine derivatives of class and preparation method of bromo-1,8-naphthyridine derivatives of class 红河学院 2016-06-08 CN disclosed
EP-0446604-A2 Pyridine and related aza heterocycle derivatives as cardiovascular agents AMERICAN CYANAMID COMPANY (US) 1991-09-18 EP disclosed
US-4169092-A Transition metal-naphthyridine chemical complexes BAYER JOHN W 1979-09-25 US disclosed