SCHEMBL31474673

SCHEMBL31474673

CC1c2ccccc2Nc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 11/20 0.48
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40
BRPF1 P55201 1/20 0.40
CREBBP Q92793 1/20 0.40
TSHR P16473 1/20 0.39
BCHE P06276 2/20 0.39
ACHE P22303 2/20 0.39
ALOX5 P09917 1/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
MAOA P21397 1/20 0.39
CNR1 P21554 1/20 0.39
PTGS1 P23219 1/20 0.39
SLC6A2 P23975 1/20 0.39

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
SCHEMBL13366003 1.00 HTR5A (0.48) HTR5AGAAMAPTBRPF1CREBBP
SCHEMBL20385185 0.84 HTR5A (0.48) HTR5AGAAMAPTBRPF1CREBBP
SCHEMBL28775952 0.84 CSNK1G1 (0.44) HTR5AMAPTCREBBPACHECYP1A2
SCHEMBL1879473 0.81 HTR5A (0.43) HTR5ABRPF1CREBBP
SCHEMBL5873718 0.81 EGFR (0.47) HTR5AMEN1ALOX12KMT2A
SCHEMBL30088920 0.81 BRPF1 (0.53) HTR5AGAAMAPTBRPF1CREBBP
SCHEMBL260994 0.81 BRPF1 (0.53) HTR5AGAAMAPTBRPF1CREBBP
SCHEMBL19054962 0.81 BRPF1 (0.53) HTR5AGAAMAPTBRPF1CREBBP
SCHEMBL16385898 0.80 LRRK2 (0.52) MAPTTSHRCYP1A2POLBMAOA
SCHEMBL28733042 0.80 HTR2C (0.42) HTR5ACREBBPMEN1HTR2CKMT2A

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
CN-119708006-A Organic compound, preparation method thereof, electron transport material, photoelectric device and display device TCL科技集团股份有限公司 2025-03-28 CN disclosed