SCHEMBL1013715

SCHEMBL1013715

NCc1cccc(-c2ccoc2)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.53
PNMT P11086 1/20 0.42
ENPP2 Q13822 1/20 0.42
TAAR1 Q96RJ0 3/20 0.42
LOXL2 Q9Y4K0 1/20 0.41
CFD P00746 2/20 0.41
CDK8 P49336 1/20 0.41
NOS3 P29474 3/20 0.41
NOS1 P29475 3/20 0.41
NOS2 P35228 3/20 0.41
SERPINE1 P05121 1/20 0.40
FYN P06241 2/20 0.39
CNR1 P21554 1/20 0.39
PTGES2 Q9H7Z7 1/20 0.39
CETP P11597 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
Hydrochloric Acid SCHEMBL1015839 0.98 CSNK2A1 (0.55) CSNK2A1PNMTENPP2TAAR1LOXL2
SCHEMBL2382129 0.86 HTR7 (0.49) CSNK2A1TAAR1LOXL2
SCHEMBL3791745 0.82 LOXL2 (0.60) CSNK2A1PNMTENPP2TAAR1LOXL2
SCHEMBL15349962 0.81 FYN (0.54) ENPP2CDK8SERPINE1FYNCNR1
SCHEMBL16160786 0.81 BCL2 (0.47) SERPINE1FYNCNR1CETP
SCHEMBL2571833 0.80 HRH3 (0.61) CSNK2A1TAAR1LOXL2
SCHEMBL15525063 0.77 MAOA (0.47) CSNK2A1SERPINE1FYNCNR1PTGES2
SCHEMBL422337 0.76 GRIN2D (0.51) ENPP2SERPINE1CNR1
SCHEMBL3794460 0.76 TAAR1 (0.70) PNMTENPP2TAAR1LOXL2CFD
SCHEMBL29400616 0.76 TAAR1 (0.70) CSNK2A1PNMTENPP2TAAR1LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3452477-B1 ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS B C I PHARMA (BE) 2023-09-13 EP disclosed
US-11236093-B2 Adenine derivatives as protein kinase inhibitors B.C.I. PHARMA (BE) 2022-02-01 US disclosed
US-20190127379-A1 ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS B.C.I. PHARMA (BE) 2019-05-02 US disclosed
US-8415479-B2 Inhibitor of plasminogen activator inhibitor-1 RENASCIENCE CO., LTD. (JP) 2013-04-09 US disclosed
US-8293715-B2 10a-Azalide compound crosslinked at 10a- and 12-positions TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-10-23 US disclosed
US-20110237784-A1 10A-AZALIDE COMPOUND CROSSLINKED AT 10A- AND 12-POSITIONS TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-09-29 US disclosed
US-20110112140-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 RENASCIENCE CO., LTD. (JP) 2011-05-12 US disclosed
EP-2272822-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 Renascience CO., LTD. (JP) 2011-01-12 EP disclosed
EP-2177526-A1 10A-AZALIDE COMPOUND CROSSLINKED AT POSITION-10A AND POSITION-12 Taisho Pharmaceutical Co. Ltd. (JP) 2010-04-21 EP 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 (4 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-20110237784-A1 10A-AZALIDE COMPOUND CROSSLINKED AT 10A- AND 12-POSITIONS DCLRE1A, AZI2, CHD9 CSNK2A1 3687/4885PNMT 4516/4885ENPP2 2110/4885
US-11236093-B2 Adenine derivatives as protein kinase inhibitors ADK, TNNI3K, TNK2 CSNK2A1 92/4885PNMT 1739/4885ENPP2 524/4885
US-20190127379-A1 ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS ADK, TNNI3K, TNK2 CSNK2A1 92/4885PNMT 1739/4885ENPP2 524/4885
US-20110112140-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 SERPINE1, SERPINB1, SERPINC1 CSNK2A1 3255/4885PNMT 3419/4885ENPP2 423/4885

“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.