SCHEMBL9512904

SCHEMBL9512904

C=CCN(C)c1ccc(Nc2ccc(N(C)CC=C)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
PYCR1 P32322 1/20 0.34
MAPT P10636 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 2/20 0.33
CYP1A2 P05177 1/20 0.33
DHFR P00374 1/20 0.32
NR4A1 P22736 1/20 0.32
CASR P41180 1/20 0.32
MAPK1 P28482 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
KDM4E B2RXH2 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL11501045 0.87 PYCR1 (0.41) GAAADRA2AADRA2BADRA2CPYCR1
SCHEMBL1083024 0.86 GAA (0.39) GAAADRA2AADRA2BADRA2CPYCR1
SCHEMBL15336561 0.78 APP (0.44) GAAPYCR1MAPTNPC1RAB9A
SCHEMBL21021269 0.78 APP (0.44) ADRA2AADRA2BADRA2CPYCR1SMN1; SMN2
SCHEMBL11406187 0.78 ALDH1A1 (0.48) GAAADRA2AADRA2BADRA2CPYCR1
SCHEMBL10795320 0.78 PYCR1 (0.56) ADRA2AADRA2BADRA2CPYCR1MAPT
SCHEMBL1257194 0.77 CA12 (0.42) PYCR1KMT2ASMN1; SMN2CYP1A2DHFR
SCHEMBL21242338 0.77 MAPT (0.35) GAAADRA2AADRA2BADRA2CMAPT
SCHEMBL9847486 0.74 GAA (0.39) GAAADRA2AADRA2BADRA2CMAPT
SCHEMBL9514288 0.74 ADRA2A (0.59) GAAADRA2AADRA2BADRA2CMAPT

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-0273418-B1 Heat-sensitive recording material using chromeno compound KANZAKI PAPER MFG CO LTD (JP) 1993-11-24 EP disclosed
US-4803193-A COLORFASTNESS; READABLE BY OPTICAL CHARACTER-READING DEVICES KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1989-02-07 US disclosed
EP-0273418-A2 Heat-sensitive recording material using chromeno compound KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1988-07-06 EP disclosed