SCHEMBL3103036

SCHEMBL3103036

[c]1nc2cc3ccccc3cc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.43
KDM4E B2RXH2 7/20 0.42
LMNA P02545 4/20 0.42
HSD17B10 Q99714 2/20 0.42
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
MAPT P10636 6/20 0.39
PDE3B Q13370 2/20 0.39
PDE3A Q14432 2/20 0.39
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 3/20 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
SCHEMBL27947333 0.75 FGFR1 (0.43) KDM4EKMT2AMEN1MAPTNPC1
SCHEMBL7409270 0.75 DYRK3 (0.43) KDM4EKMT2AMEN1MAPTL3MBTL1
SCHEMBL2862 0.73
SCHEMBL440275 0.70 MAPK13 (0.41) KDM4ELMNAHSD17B10KMT2AMEN1
SCHEMBL21001888 0.68 KDM4E (0.37) NQO2KDM4ELMNAHSD17B10KMT2A
SCHEMBL356787 0.67 MEN1 (0.46) NQO2KDM4ELMNAHSD17B10KMT2A
SCHEMBL207131 0.67 ALPL (0.41) KDM4EKMT2APDE3BPDE3A
SCHEMBL207659 0.67 F7 (0.42) KDM4EHSD17B10KMT2AMEN1MAPT
SCHEMBL5981619 0.67 DYRK1A (0.42) KDM4ELMNAKMT2AMEN1MAPT
SCHEMBL10973210 0.67 PRKCI (0.47) KDM4EHSD17B10KMT2AMEN1MAPT

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11040966-B2 Benzimidazole-proline derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2021-06-22 US claimed
US-20190263797-A1 BENZIMIDAZOLE-PROLINE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2019-08-29 US claimed
US-20170305897-A1 BENZIMIDAZOLE-PROLINE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2017-10-26 US claimed
EP-2855453-B1 BENZIMIDAZOLE-PROLINE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2016-12-07 EP claimed
US-20150166527-A1 BENZIMIDAZOLE-PROLINE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2015-06-18 US claimed
EP-0061094-B1 ELECTROPHOTOGRAPHIC RECORDING MATERIAL BASF Aktiengesellschaft (DE) 1985-10-02 EP claimed
EP-0061091-B1 ELECTROPHOTOGRAPHIC RECORDING MATERIAL BASF Aktiengesellschaft (DE) 1985-08-28 EP claimed
US-4481272-A ISOINDOLE DYES BASF AKTIENGESELLSCHAFT (DE) 1984-11-06 US claimed
US-4389475-A ISOINDOLE DYES BASF AKTIENGESELLSCHAFT (DE) 1983-06-21 US claimed
EP-0061094-A1 Electrophotographic recording material BASF Aktiengesellschaft (DE) 1982-09-29 EP claimed
US-11040966-B2 Benzimidazole-proline derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2021-06-22 US disclosed
US-20190263797-A1 BENZIMIDAZOLE-PROLINE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2019-08-29 US disclosed
US-10329287-B2 Benzimidazole-proline derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2019-06-25 US disclosed
US-20170305897-A1 BENZIMIDAZOLE-PROLINE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2017-10-26 US disclosed
US-9732075-B2 Benzimidazole-proline derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2017-08-15 US disclosed
WO-1999026933-A1 SUBSTITUTED AMIDINOARYL DERIVATIVES AND THEIR USE AS ANTICOAGULANTS AXYS PHARMACEUTICALS, INC. (US) 1999-06-03 WO disclosed
EP-0061094-B1 ELECTROPHOTOGRAPHIC RECORDING MATERIAL BASF Aktiengesellschaft (DE) 1985-10-02 EP disclosed
US-4481272-A ISOINDOLE DYES BASF AKTIENGESELLSCHAFT (DE) 1984-11-06 US disclosed
US-4389475-A ISOINDOLE DYES BASF AKTIENGESELLSCHAFT (DE) 1983-06-21 US disclosed
EP-0061094-A1 Electrophotographic recording material BASF Aktiengesellschaft (DE) 1982-09-29 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 (5 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-20150166527-A1 BENZIMIDAZOLE-PROLINE DERIVATIVES HCRTR1, HCRTR2, NPY1R NQO2 917/4885KDM4E 2288/4885LMNA 2615/4885
US-10329287-B2 Benzimidazole-proline derivatives HCRTR1, HCRTR2, NPY1R NQO2 905/4885KDM4E 2320/4885LMNA 2613/4885
US-11040966-B2 Benzimidazole-proline derivatives HCRTR1, HCRTR2, NPY1R NQO2 905/4885KDM4E 2320/4885LMNA 2613/4885
US-20190263797-A1 BENZIMIDAZOLE-PROLINE DERIVATIVES HCRTR1, HCRTR2, NPY1R NQO2 905/4885KDM4E 2320/4885LMNA 2613/4885
US-20170305897-A1 BENZIMIDAZOLE-PROLINE DERIVATIVES HCRTR1, HCRTR2, NPY1R NQO2 905/4885KDM4E 2320/4885LMNA 2613/4885

“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.