SCHEMBL3783150

SCHEMBL3783150

CC(N)c1ccc(C(N)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 8/20 0.53
▸ ROCK2 O75116 2/20 0.50
▸ ROCK1 Q13464 2/20 0.50
▸ PARP4 Q9UKK3 2/20 0.48
▸ PARP1 P09874 2/20 0.48
▸ CA2 P00918 2/20 0.48
▸ CA1 P00915 1/20 0.48
▸ PARP2 Q9UGN5 1/20 0.48
▸ ADRB2 P07550 1/20 0.48
▸ PARP15 Q460N3 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ PARP14 Q460N5 1/20 0.46
▸ PARP16 Q8N5Y8 1/20 0.46
▸ PARP11 Q9NR21 1/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ MAPT P10636 1/20 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
SCHEMBL12052082 1.00 PARP10 (0.53) PARP10ROCK2ROCK1PARP4PARP1
SCHEMBL8254658 1.00 PARP10 (0.53) PARP10ROCK2ROCK1PARP4PARP1
SCHEMBL84429 0.84 HTT (0.61) PARP10PARP4PARP1CA2CA1
SCHEMBL28953743 0.84 ROCK2 (0.51) ROCK2ROCK1ADRB2ALDH1A1KMT2A
Water SCHEMBL4672025 0.82 HTT (0.59) PARP10PARP4PARP1CA2CA1
SCHEMBL2422833 0.82 PARP10 (0.53) PARP10PARP4PARP1CA2CA1
SCHEMBL4878931 0.82 ANPEP (0.57) ROCK2ROCK1CA2CA1ADRB2
SCHEMBL12600654 0.82 PARP10 (0.53) PARP10PARP4PARP1CA2CA1
Hydrochloric Acid SCHEMBL4372836 0.82 HTT (0.59) PARP10PARP4PARP1CA2CA1
Terephthalic Acid SCHEMBL8743590 0.82 ANPEP (0.57) ROCK2ROCK1CA2CA1ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12527779-B2 Prostaglandin E2 (PGE2) EP4 receptor antagonists DOMAIN THERAPEUTICS (FR) 2026-01-20 — — US disclosed
EP-4038052-B1 PROSTAGLANDIN E2 (PGE2) EP4 RECEPTOR ANTAGONISTS DOMAIN THERAPEUTICS (FR) 2024-02-07 — — EP disclosed
US-20220378772-A1 PROSTAGLANDIN E2 (PGE2) EP4 RECEPTOR ANTAGONISTS DOMAIN THERAPEUTICS (FR) 2022-12-01 — — US disclosed
CN-114555573-A Prostaglandin E2(PGE2)EP4Receptor antagonists 多曼治疗学公司 2022-05-27 — — CN disclosed
US-20190292157-A1 NOVEL HETEROCYCLIC COMPOUNDS AS INHIBITORS OF VANIN-1 ENZYME PFIZER INC. (US) 2019-09-26 — — US disclosed
US-20190292157-A1 NOVEL HETEROCYCLIC COMPOUNDS AS INHIBITORS OF VANIN-1 ENZYME PFIZER INC. (US) 2019-09-26 — — US disclosed
US-10308615-B2 Heterocyclic compounds as inhibitors of Vanin-1 enzyme PFIZER INC. (US) 2019-06-04 — — US disclosed
US-10308615-B2 Heterocyclic compounds as inhibitors of Vanin-1 enzyme PFIZER INC. (US) 2019-06-04 — — US disclosed
US-20180148420-A1 NOVEL HETEROCYCLIC COMPOUNDS AS INHIBITORS OF VANIN-1 ENZYME PFIZER INC. (US) 2018-05-31 — — US disclosed
US-20180148420-A1 NOVEL HETEROCYCLIC COMPOUNDS AS INHIBITORS OF VANIN-1 ENZYME PFIZER INC. (US) 2018-05-31 — — US disclosed
CN-100411686-C Agent for improving visual function disorder SENJU PHARMA CO (JP) 2008-08-20 — — CN disclosed
CN-1323719-C Remedy for glaucoma comprising Rho kinase inhibitor and beta-blocker SANTEN PHARMACEUTICAL CO LTD (JP) 2007-07-04 — — CN disclosed
WO-2006116157-A9 DIPEPTIDYL PEPTIDASE-IV INHIBITORS ALANTOS PHARMACEUTICALS INC (US) 2007-03-01 — — WO disclosed
WO-2006116157-A2 DIPEPTIDYL PEPTIDASE-IV INHIBITORS ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2006-11-02 — — WO disclosed
CN-1711107-A Remedy for glaucoma comprising Rho kinase inhibitor and beta-blocker SANTEN PHARMACEUTICAL CO LTD (JP) 2005-12-21 — — CN disclosed
CN-1684689-A Glaucoma-treating agent consisting of RHo kinase inhibitor and prostaglandin SANTEN PHARMACEUTICAL CO LTD (JP) 2005-10-19 — — CN disclosed
CN-1501813-A Agent for improving visual function disorder 千寿制药株式会社 2004-06-02 — — CN disclosed
US-4894387-A RELIEF FROM PAIN FROM VASODILATION GLAXO GROUP LIMITED (GB) 1990-01-16 — — US disclosed
EP-0147107-B1 INDOLE DERIVATES GLAXO GROUP LIMITED (GB) 1989-08-02 — — EP disclosed
EP-0147107-A1 Indole derivates GLAXO GROUP LIMITED (GB) 1985-07-03 — — 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-12527779-B2 Prostaglandin E2 (PGE2) EP4 receptor antagonists PTGER1, PTGER4, PTGER3 PARP10 1019/4885ROCK2 1632/4885ROCK1 1446/4885
US-20190292157-A1 NOVEL HETEROCYCLIC COMPOUNDS AS INHIBITORS OF VANIN-1 ENZYME VNN1, VAT1, CMA1 PARP10 1790/4885ROCK2 4847/4885ROCK1 4714/4885
US-10308615-B2 Heterocyclic compounds as inhibitors of Vanin-1 enzyme VNN1, MVD, VAT1 PARP10 2359/4885ROCK2 4870/4885ROCK1 4804/4885
US-20220378772-A1 PROSTAGLANDIN E2 (PGE2) EP4 RECEPTOR ANTAGONISTS PTGER4, PTGER1, PTGER2 PARP10 891/4885ROCK2 1222/4885ROCK1 1245/4885
US-20180148420-A1 NOVEL HETEROCYCLIC COMPOUNDS AS INHIBITORS OF VANIN-1 ENZYME VNN1, CMA1, VAT1 PARP10 2356/4885ROCK2 4858/4885ROCK1 4638/4885

“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.

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