SCHEMBL741500

SCHEMBL741500

COc1ccccc1C(=O)CC#N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.60
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
NPC1 O15118 1/20 0.57
CTSD P07339 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
ALDH1A1 P00352 3/20 0.51
HTT P42858 1/20 0.51
CTNNB1 P35222 2/20 0.50
WNT3A P56704 2/20 0.50
IDO1 P14902 1/20 0.50
TDO2 P48775 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC1 Q13547 1/20 0.50
LMNA P02545 2/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 1/20 0.48
HSD17B10 Q99714 1/20 0.48
HPGD P15428 2/20 0.46

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
SCHEMBL12536449 0.83 MAPT (0.57) MAPTKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL138885 0.82 IDO1 (0.50) MAPTKMT2AMEN1NPC1L3MBTL1
SCHEMBL395494 0.81 MAPT (0.56) MAPTKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL28573906 0.81 SMN1; SMN2 (0.51) MAPTKMT2AMEN1NPC1HTT
SCHEMBL5675350 0.81 HPGDS (0.66) MAPTKMT2AMEN1ALDH1A1HTT
SCHEMBL12536506 0.81 MAPT (0.58) MAPTKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL17380989 0.80 MAPT (0.78) MAPTKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL21128714 0.80 NPC1 (0.83) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL29987209 0.80 NPC1 (0.83) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL15979734 0.80 CTNNB1 (0.71) KMT2ANPC1CTSDL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250145628-A1 PYRAZOLOPYRIMIDINES, COMPOSITIONS COMPRISING THEM AND USES THEREOF NOVO NORDISK A/S (DK) 2025-05-08 US disclosed
WO-2025064210-A1 INHIBITORS OF BILIVERDIN REDUCTASE B (BLVRB) BLOOD CELL TECHNOLOGIES, LLC (US) 2025-03-27 WO disclosed
CN-119301126-A Pyrazolopyrimidine compound, composition containing pyrazolopyrimidine compound and application of pyrazolopyrimidine compound 诺和诺德股份有限公司 2025-01-10 CN disclosed
CN-119192171-A Small molecule compounds and their use in vitro expansion of hematopoietic stem cells and/or progenitor cells 上海交通大学医学院 2024-12-27 CN disclosed
EP-4479402-A1 PYRAZOLOPYRIMIDINES, COMPOSITIONS COMPRISING THEM AND USES THEREOF Novo Nordisk A/S (DK) 2024-12-25 EP disclosed
US-20240277683-A1 COMPOUNDS CTXT PTY LTD (AU) 2024-08-22 US disclosed
CN-117624188-A Cyclopentathiofuran carboxamide derivatives as platelet-activating factor receptor antagonists 勃林格殷格翰国际有限公司 2024-03-01 CN disclosed
US-11911372-B2 Compounds CTXT PTY LTD (AU) 2024-02-27 US disclosed
US-11911372-B2 Compounds CTXT PTY LTD (AU) 2024-02-27 US disclosed
US-11911372-B2 Compounds CTXT PTY LTD (AU) 2024-02-27 US disclosed
US-4728743-A Process for the production of 3-oxonitriles DEGUSSA AKTIENGESELLSCHAFT (DE) 1988-03-01 US disclosed
US-4716237-A Process for the production of 3-oxonitriles DEGUSSA AKTIENGESELLSCHAFT (DE) 1987-12-29 US disclosed
EP-0089011-B1 PROCESS FOR THE PREPARATION OF 5-OXONITRILES Degussa Aktiengesellschaft (DE) 1985-07-10 EP disclosed
EP-0089011-A1 Process for the preparation of 5-oxonitriles Degussa Aktiengesellschaft (DE) 1983-09-21 EP disclosed
EP-0016277-B1 2-CARBONYL-3-HYDROXY-ALKENONITRILES, THEIR USE AS ANTI-ARTHRITIC AGENTS AND PROCESSES FOR THEIR PREPARATION AMERICAN CYANAMID COMPANY (US) 1981-12-02 EP disclosed
US-4259256-A ANTIINFLAMMATORY AMERICAN CYANAMID COMPANY (US) 1981-03-31 US disclosed
EP-0016277-A1 2-Carbonyl-3-hydroxy-alkenonitriles, their use as anti-arthritic agents and processes for their preparation AMERICAN CYANAMID COMPANY (US) 1980-10-01 EP disclosed
WO-1980000964-A1 ANTI-INFLAMMATORY AGENTS INCLUDING 2-CARBONYL-3-HYDROXY-2-ALKENONITRILES AMERICAN CYANAMID CO (US) 1980-05-15 WO disclosed
US-4181677-A ANTIINFLAMMATORY AGENTS AMERICAN CYANAMID COMPANY (US) 1980-01-01 US disclosed
US-4173650-A ANTIARTHRITIC AGENTS AMERICAN CYANAMID COMPANY (US) 1979-11-06 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 (3 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-20240277683-A1 COMPOUNDS SLC10A1, ABCB11, REN MAPT 1141/4885KMT2A 4313/4885MEN1 107/4885
US-20250145628-A1 PYRAZOLOPYRIMIDINES, COMPOSITIONS COMPRISING THEM AND USES THEREOF CNR1, CNR2, TRPV1 MAPT 74/4885KMT2A 3336/4885MEN1 2114/4885
US-11911372-B2 Compounds SLC10A1, ABCB11, REN MAPT 1236/4885KMT2A 4080/4885MEN1 114/4885

“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.