SCHEMBL29040260

SCHEMBL29040260

C#CC1NCCc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRCP P42785 8/20 0.53
GAA P10253 2/20 0.51
SLC22A1 O15245 1/20 0.47
RECQL P46063 1/20 0.47
TSHR P16473 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
GID4 Q8IVV7 1/20 0.44
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
MAPT P10636 1/20 0.41
AGTR1 P30556 1/20 0.41
OPRM1 P35372 2/20 0.40

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
SCHEMBL95058 0.81 PRCP (0.53) PRCPGAASLC22A1RECQLTSHR
SCHEMBL1033480 0.81 PRCP (0.53) PRCPGAASLC22A1RECQLTSHR
SCHEMBL20577212 0.81 CYP2D6 (0.38) PRCPTSHRMAPT
SCHEMBL16968352 0.75 PRCP (0.49) PRCPGAASLC22A1RECQLTSHR
SCHEMBL24017043 0.74 PRCP (0.70) PRCPGAASLC22A1RECQLTSHR
SCHEMBL16799768 0.74 PRCP (0.70) PRCPGAASLC22A1RECQLTSHR
SCHEMBL30368634 0.74 PRCP (0.70) PRCPGAASLC22A1RECQLTSHR
SCHEMBL16968353 0.71 PRCP (0.71) PRCPGAASLC22A1RECQLTSHR
SCHEMBL327182 0.71 PRCP (0.58) PRCPGAASLC22A1RECQLTSHR
SCHEMBL8823898 0.71 PRCP (0.58) PRCPGAASLC22A1RECQLTSHR

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-116323857-A Photochromic compound, photochromic composition, photochromic article and glasses 豪雅镜片泰国有限公司 2023-06-23 CN disclosed