Sugi Predict

Sugi Predict / Compounds / SCHEMBL4825571

SCHEMBL4825571

SCHEMBL4825571

O=C(O)C1(c2cccnc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AKR1C1 Q04828 1/20 0.53
▸ ALDH1A1 P00352 4/20 0.49
▸ LMNA P02545 1/20 0.49
▸ KMT2A Q03164 2/20 0.46
▸ VNN1 O95497 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ HCAR2 Q8TDS4 2/20 0.46
▸ APP P05067 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ HCAR3 P49019 1/20 0.46
▸ HSD11B1 P28845 1/20 0.44
▸ PLOD2 O00469 1/20 0.43
▸ PKM P14618 1/20 0.42
▸ NAPRT Q6XQN6 1/20 0.42

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 SCHEMBL23778493 0.98 AKR1C1 (0.52) AKR1C1ALDH1A1LMNAKMT2AVNN1
SCHEMBL9338162 0.93 AKR1C1 (0.65) AKR1C1ALDH1A1LMNAKMT2AVNN1
SCHEMBL17896072 0.91 AKR1C1 (0.62) AKR1C1ALDH1A1LMNAKMT2AVNN1
SCHEMBL8302463 0.89 ITGA4 (0.46) AKR1C1ALDH1A1LMNAKMT2AVNN1
Hydrochloric Acid SCHEMBL8350428 0.87 ITGA4 (0.45) AKR1C1ALDH1A1LMNAKMT2AVNN1
SCHEMBL3441871 0.86 ALDH1A1 (0.54) AKR1C1ALDH1A1LMNAKMT2AMEN1
SCHEMBL27953257 0.86 ITGA4 (0.48) AKR1C1ALDH1A1LMNAKMT2AMEN1
SCHEMBL10002454 0.84 OPRM1 (0.49) ALDH1A1LMNAKMT2AVNN1MEN1
SCHEMBL16700345 0.83 ALDH1A1 (0.42) AKR1C1ALDH1A1LMNAKMT2AVNN1
SCHEMBL6422989 0.80 CHRM2 (0.59) ALDH1A1LMNAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12528798-B2 Compound for crop protectant LG CHEM, LTD. (KR) 2026-01-20 — — US disclosed
US-20250236608-A1 EGFR INHIBITORS BLUEPRINT MEDICINES CORPORATION 2025-07-24 — — US disclosed
US-20240246945-A1 NOVEL COMPOUND FOR CROP PROTECTANT LG CHEM, LTD. (KR) 2024-07-25 — — US disclosed
US-11912686-B2 LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2024-02-27 — — US disclosed
US-11912686-B2 LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2024-02-27 — — US disclosed
CN-110088089-B Benzyl amino pyridyl cyclopropane carboxylic acid, pharmaceutical composition and application thereof 勃林格殷格翰国际有限公司 2023-08-29 — — CN disclosed
US-20230212151-A1 LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2023-07-06 — — US disclosed
US-20230212151-A1 LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2023-07-06 — — US disclosed
CN-111032647-B Lysophosphatidic acid receptor 1 (LPAR 1) inhibitor compounds 伊莱利利公司 2023-05-02 — — CN disclosed
US-11584738-B2 LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2023-02-21 — — US disclosed
CN-104927879-A LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY DEVICE JSR CORP 2015-09-23 — — CN disclosed
US-20150087585-A1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS PFIZER INC. (US) 2015-03-26 — — US disclosed
EP-2834238-A1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS Pfizer Inc. (US) 2015-02-11 — — EP disclosed
CN-104334557-A Diacylglycerol acyltransferase 2 inhibitors PFIZER 2015-02-04 — — CN disclosed
US-20130303525-A1 KAPPA OPIOID RECEPTOR AGONISTS DR. REDDY'S LABORATORIES, INC. (US) 2013-11-14 — — US disclosed
US-20130303525-A1 KAPPA OPIOID RECEPTOR AGONISTS DR. REDDY'S LABORATORIES, INC. (US) 2013-11-14 — — US disclosed
WO-2013150416-A1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS PFIZER INC. (US) 2013-10-10 — — WO disclosed
WO-2012164085-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO. KGAA (DE) 2012-12-06 — — WO disclosed
US-7423067-B2 N-(3,4-diphenyl-2-butyl)cyclopentancarboxamide derivatives such as N-(2,3-bis(4-chlorophenyl)-1-methylpropyl)-3-benzoyl-cyclopentane-carboxamide; used for treating conditions including psychological disorders, eating disorders and substance abuse MERCK & CO., INC. (US) 2008-09-09 — — US disclosed
US-20050239828-A1 Spirocyclic amides as cannabinoid receptor modulators MERCK & CO., INC. (US) 2005-10-27 — — 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 (9 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-11584738-B2 LPA receptor antagonists and uses thereof LPAR1, LPAR2, LPAR4 AKR1C1 304/4885ALDH1A1 1726/4885LMNA 1162/4885
US-20240246945-A1 NOVEL COMPOUND FOR CROP PROTECTANT KEAP1, BROX, GPX1 AKR1C1 1123/4885ALDH1A1 2249/4885LMNA 2246/4885
US-20150087585-A1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITORS DGAT2, DGAT1, PLAAT2 AKR1C1 1447/4885ALDH1A1 453/4885LMNA 3540/4885
US-20130303525-A1 KAPPA OPIOID RECEPTOR AGONISTS OPRK1, OPRL1, OPRD1 AKR1C1 494/4885ALDH1A1 1649/4885LMNA 3849/4885
US-12528798-B2 Compound for crop protectant CBR1, CBR3, GSTO1 AKR1C1 1252/4885ALDH1A1 2445/4885LMNA 1868/4885
US-20250236608-A1 EGFR INHIBITORS EGFR, ERBB2, ERBB3 AKR1C1 3944/4885ALDH1A1 2147/4885LMNA 4778/4885
US-20050239828-A1 Spirocyclic amides as cannabinoid receptor modulators CNR1, CNR2, MAG AKR1C1 1581/4885ALDH1A1 2505/4885LMNA 1329/4885
US-20230212151-A1 LPA RECEPTOR ANTAGONISTS AND USES THEREOF LPAR1, LPAR2, LPAR4 AKR1C1 304/4885ALDH1A1 1726/4885LMNA 1162/4885
US-11912686-B2 LPA receptor antagonists and uses thereof LPAR1, LPAR2, LPAR4 AKR1C1 304/4885ALDH1A1 1726/4885LMNA 1162/4885

“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.