SCHEMBL4640523

SCHEMBL4640523

Clc1ccc2nc3c(nc2c1)N(Cc1ccccc1)CN3Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.50
KDM4E B2RXH2 6/20 0.46
KMT2A Q03164 3/20 0.46
CYP1A2 P05177 1/20 0.46
POLB P06746 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPT P10636 5/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HTR3E A5X5Y0 2/20 0.45
HTR3B O95264 2/20 0.45
HTR2C P28335 2/20 0.45
HTR3A P46098 2/20 0.45
HTR3D Q70Z44 2/20 0.45
HTR3C Q8WXA8 2/20 0.45
HTR1A P08908 1/20 0.45
SIGMAR1 Q99720 3/20 0.43

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
SCHEMBL9464035 0.80 HRH4 (0.46) HRH4KDM4EKMT2ACYP1A2CYP3A4
SCHEMBL4640511 0.76 ALDH1A1 (0.43) HRH4KDM4EKMT2ACYP1A2CYP3A4
SCHEMBL4640583 0.75 HRH4 (0.43) HRH4KDM4EKMT2ACYP1A2CYP2C9
SCHEMBL5157721 0.70 NQO2 (0.56) KDM4EKMT2APOLBMAPTSMN1; SMN2
SCHEMBL29856205 0.70 NQO2 (0.56) KDM4EKMT2APOLBMAPTSMN1; SMN2
SCHEMBL5157381 0.68 PIK3CG (0.58) HRH4KDM4EKMT2ACYP1A2POLB
SCHEMBL11596282 0.67 NQO2 (0.65) KDM4EKMT2APOLBMAPTSMN1; SMN2
SCHEMBL6262638 0.66 KDM4E (0.71) KDM4EKMT2ACYP3A4MAPTSMN1; SMN2
SCHEMBL11728599 0.66 KDM4E (0.55) KDM4EKMT2ACYP1A2POLBCYP3A4
SCHEMBL17878833 0.66 KDM4E (0.48) HRH4KDM4EKMT2ACYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1298490-B1 Photopolymerizable composition and recording material FUJIFILM CORP (JP) 2008-08-13 EP disclosed
US-6756177-B2 MULTICOLOR RECORDING FUJI PHOTO FILM CO., LTD. (JP) 2004-06-29 US disclosed
US-6740466-B1 HIGH SENSITIVITY TO UV, VISIBLE, ANDINFRARED; FOGGING OF THE BACKGROUND IS REDUCED; CLARITY AND HIGH CONTRAST; ADDITION POLYMERIZABLE COMPOUND, AN INDOLE-PYRIMIDINETRIONE METHINE DYE, AN ANIONIC ORGANOBORON COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 2004-05-25 US disclosed
US-20030129521-A1 Photopolymerizable composition and recording material FUJI PHOTO FILM CO., LTD. 2003-07-10 US disclosed
EP-1298490-A2 Photopolymerizable composition and recording material Fuji Photo Film Co., Ltd. (JP) 2003-04-02 EP disclosed
US-5578414-A CYANINE DYE, ONIUM SALT, AND HYDRAZINE COMPOUND; HIGH CONTRAST FUJI PHOTO FILM CO., LTD. (JP) 1996-11-26 US disclosed
US-5547828-A CYANINE DYES FUJI PHOTO FILM CO., LTD. (JP) 1996-08-20 US disclosed