SCHEMBL27439451

SCHEMBL27439451

CC1CCN(c2ccc(-c3ccccc3)cc2)C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.47
MCHR1 Q99705 5/20 0.47
PDK2 Q15119 1/20 0.46
HRH3 Q9Y5N1 4/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
NOTUM Q6P988 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MCL1 Q07820 1/20 0.43
GAA P10253 1/20 0.42
ADORA2A P29274 1/20 0.42
ADORA1 P30542 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
SCHEMBL12449705 0.89 NOTUM (0.55) USP2PDK2HTTNPSR1NOTUM
SCHEMBL12839 0.89 NOTUM (0.55) USP2PDK2HTTNPSR1NOTUM
SCHEMBL12449707 0.89 NOTUM (0.55) USP2PDK2HTTNPSR1NOTUM
SCHEMBL24418020 0.84 ALDH1A1 (0.46) USP2MCHR1PDK2HRH3HTT
Nitrogen SCHEMBL11225878 0.81 NOTUM (0.45) USP2PDK2HTTNPSR1NOTUM
SCHEMBL19314278 0.79 USP2 (0.47) USP2PDK2HTTNPSR1MEN1
SCHEMBL21460344 0.79 NAMPT (0.50) MCHR1HRH3NOTUM
SCHEMBL21460347 0.79 NAMPT (0.50) MCHR1HRH3NOTUM
SCHEMBL13056 0.78 MAPT (0.52) HTTNOTUMMEN1KMT2ANPC1
SCHEMBL12919 0.78 MAPT (0.52) HTTNOTUMMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4393923-A1 PYRIDO RING COMPOUND, PREPARATION METHOD THEREFOR, INTERMEDIATE, COMPOSITION, AND APPLICATION Yiyou Biotech (Shanghai) Co., Ltd. (CN) 2024-07-03 EP disclosed