SCHEMBL2846677

SCHEMBL2846677

CCOc1c(C=C2N(CC)c3ccc4ccccc4c3C2(C)C)c(=O)c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 9/20 0.47
BLM P54132 1/20 0.37
MLNR O43193 1/20 0.35
NR1I2 O75469 1/20 0.35
PGR P06401 1/20 0.35
ADRB1 P08588 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CHRM1 P11229 1/20 0.35
DRD2 P14416 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
CHRM3 P20309 1/20 0.35
CNR1 P21554 1/20 0.35
DRD1 P21728 1/20 0.35
TBXA2R P21731 1/20 0.35
SLC6A2 P23975 1/20 0.35
HRH2 P25021 1/20 0.35
HTR2C P28335 1/20 0.35
BDKRB2 P30411 1/20 0.35
ADORA1 P30542 1/20 0.35

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
SCHEMBL2846676 1.00 PRMT1 (0.47) PRMT1BLMMLNRNR1I2PGR
SCHEMBL2846007 0.84 PRMT1 (0.49) PRMT1BLMMLNRNR1I2PGR
SCHEMBL2846009 0.84 PRMT1 (0.49) PRMT1BLMMLNRNR1I2PGR
SCHEMBL15178538 0.79 PRMT1 (0.41) PRMT1BLMMLNRNR1I2PGR
SCHEMBL12156973 0.77 PRMT1 (0.44) PRMT1BLMMLNRNR1I2PGR
SCHEMBL14596157 0.76 PRMT1 (0.58) PRMT1BLMMLNRNR1I2PGR
SCHEMBL18103640 0.76 PRMT1 (0.58) PRMT1BLMMLNRNR1I2PGR
SCHEMBL7701839 0.74 ABCG2 (0.32) PRMT1MEN1KMT2APOLBALDH1A1
SCHEMBL3468060 0.73 MAPT (0.45) MEN1KMT2APOLBALDH1A1MAPT
SCHEMBL3468065 0.73 MAPT (0.45) MEN1KMT2APOLBALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100129293-A1 Near Infrared Imaging Agent INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH AN DER FREIEN UNIVERSITAT BERLIN (DE) 2010-05-27 US disclosed
US-7655217-B2 Near infrared imaging agent Institut fur Diagnosikforschung GmbH (DE) 2010-02-02 US disclosed
US-7445767-B2 In-vivo diagnostic method by near infrared radiation INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH AN DER FREIEN UNIVERSITAT BERLIN (DE) 2008-11-04 US disclosed
US-20060165599-A1 Near infrared imaging agent INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH (DE) 2006-07-27 US disclosed
US-20060165598-A1 In-vivo diagnostic method by near infrared radiation INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH AN DER FREIEN UNIVERSITAT BERLIN (DE) 2006-07-27 US disclosed
US-7025949-B2 In-vivo diagnostic method by means of near infrared radiation INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH AN DER FREIEN UNIVERSITAT BERLIN (DE) 2006-04-11 US disclosed
US-6926885-B2 In-vivo diagnostic method by means of near infrared radiation INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH (DE) 2005-08-09 US disclosed
US-20050169844-A1 Near infrared imaging agent INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH AN DER FREIEN UNIVERSITAT BERLIN (DE) 2005-08-04 US disclosed
US-6913743-B2 As contrast medium for fluorescence and transillumination diagnostics; drugs INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH AN DER FREIEN UNIVERSITAT BERLIN (DE) 2005-07-05 US disclosed
US-20050106106-A1 In-vivo diagnostic method by near infrared radiation INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH AN DER FREIEN UNIVERSITAT BERLIN (DE) 2005-05-19 US disclosed
US-20030170179-A1 Near infrared imaging agent INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH AN DER FREIEN UNIVERSITA (COPY) 2003-09-11 US disclosed
US-20030026763-A1 In-vivo diagnostic method by means of near infrared radiation INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH AN DER FREIEN UNIVERSITAT BERLIN 2003-02-06 US disclosed
EP-1181940-A2 In vivo diagnostics by near infrared radiation INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) 2002-02-27 EP disclosed
US-20010055567-A1 In-vivo diagnostic method by means of near infrared radiation INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH AN DER FREIEN UNIVERSITAT BERLIN 2001-12-27 US disclosed
US-6258340-B1 USING WATER-SOLUBLE DYES AND THEIR BIOMOLECULE ADDUCTS EACH HAVING SPECIFIC PHOTOPHYSICAL AND PHARMOCHEMICAL PROPERTIES INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH (DE) 2001-07-10 US disclosed
US-6083485-A USEING WATER-SOLUBLE DYES AND THEIR BIOMOLECULE ADDUCTS AS CONTRAST MEDIUM FOR FLUORESCENCE AND TRANSILLUMINATION DIAGNOSTICS IN THE NEAR INFRARED RADIATION RANGE INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH (DE) 2000-07-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060165598-A1 In-vivo diagnostic method by near infrared radiation GUSB, CYBA, ABCG2 PRMT1 2769/4885BLM 628/4885MLNR 1519/4885
US-20100129293-A1 Near Infrared Imaging Agent UGT1A10, ABCG2, SLCO1B1 PRMT1 2675/4885BLM 1226/4885MLNR 723/4885
US-20050106106-A1 In-vivo diagnostic method by near infrared radiation GUSB, CYBA, ABCG2 PRMT1 2769/4885BLM 628/4885MLNR 1519/4885
US-20050169844-A1 Near infrared imaging agent UGT1A10, ABCG2, SLCO1B1 PRMT1 2675/4885BLM 1226/4885MLNR 723/4885
US-20060165599-A1 Near infrared imaging agent UGT1A10, ABCG2, SLCO1B1 PRMT1 2675/4885BLM 1226/4885MLNR 723/4885
US-20010055567-A1 In-vivo diagnostic method by means of near infrared radiation GUSB, ABCG2, SLCO1B1 PRMT1 3243/4885BLM 767/4885MLNR 1140/4885
US-20030026763-A1 In-vivo diagnostic method by means of near infrared radiation GUSB, ABCG2, SLCO1B1 PRMT1 3243/4885BLM 767/4885MLNR 1140/4885
US-20030170179-A1 Near infrared imaging agent UGT1A10, ABCG2, SLCO1B1 PRMT1 2675/4885BLM 1226/4885MLNR 723/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.