SCHEMBL6966533

SCHEMBL6966533

CNC(C(=O)OC)C(C)C

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 4/20 0.58
CA12 O43570 3/20 0.58
SMN1; SMN2 Q16637 4/20 0.48
TSHR P16473 1/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MAPT P10636 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 2/20 0.38
THRB P10828 1/20 0.37
BIRC2 Q13490 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL13204470 1.00 CA14 (0.58) CA14CA12SMN1; SMN2TSHRCA7
SCHEMBL7274381 1.00 CA14 (0.58) CA14CA12SMN1; SMN2TSHRCA7
Hydrochloric Acid SCHEMBL17559741 0.97 CA14 (0.56) CA14CA12SMN1; SMN2TSHRCA7
Hydrochloric Acid SCHEMBL1761465 0.97 CA14 (0.56) CA14CA12SMN1; SMN2TSHRCA7
Hydrochloric Acid SCHEMBL29398016 0.97 CA14 (0.56) CA14CA12SMN1; SMN2TSHRCA7
SCHEMBL24445693 0.82 CA14 (0.45) CA14CA12SMN1; SMN2TSHRCA7
SCHEMBL8164724 0.82 CA14 (0.45) CA14CA12SMN1; SMN2TSHRCA7
SCHEMBL24556376 0.82 CA14 (0.45) CA14CA12SMN1; SMN2TSHRCA7
SCHEMBL10654071 0.82 CA12 (0.40) CA14CA12SMN1; SMN2TSHRCA7
SCHEMBL9925882 0.82 CA14 (0.45) CA14CA12SMN1; SMN2TSHRCA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688789-A1 MACROCYCLIC RAS INHIBITORS Revolution Medicines, Inc. (US) 2026-02-11 EP disclosed
EP-4656201-A2 RAS INHIBITORS Revolution Medicines, Inc. (US) 2025-12-03 EP disclosed
US-12384790-B2 Pteridinone compounds and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-08-12 US disclosed
US-20250195521-A1 USE OF SOS1 INHIBITORS TO TREAT MALIGNANCIES WITH SHP2 MUTATIONS Revolution Medicines, Inc. 2025-06-19 US disclosed
CN-115873020-B RAS inhibitors 锐新医药公司 2025-06-13 CN disclosed
US-20250136577-A1 HETEROCYCLIC DERIVATIVES AS MALT1 INHIBITORS C4X DISCOVERY LIMITED (GB) 2025-05-01 US disclosed
WO-2025045233-A1 MACROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, AND USE THEREOF 劲方医药科技(上海)股份有限公司 2025-03-06 WO disclosed
US-20250051306-A1 RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2025-02-13 US disclosed
WO-2024211663-A9 MACROCYCLIC RAS INHIBITORS Revolution Medicines, Inc. (US) 2025-01-30 WO disclosed
EP-4472734-A1 HETEROCYCLIC DERIVATIVES AS MALT1 INHIBITORS C4X Discovery Limited (GB) 2024-12-11 EP disclosed
US-20140235789-A1 SOLID PHASE PEPTIDE SYNTHESIS VIA SIDE CHAIN ATTACHMENT CHEMICAL & BIOPHARMACEUTICAL LABORATORIES OF PATRAS S.A. (GR) 2014-08-21 US disclosed
US-8436028-B2 CETP inhibitors derived from benzoxazole arylamides MERCK SHARP & DOHME CORP (US) 2013-05-07 US disclosed
US-8119654-B2 Indenoisoquinolinone analogs and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION (US) 2012-02-21 US disclosed
EP-1633724-B1 PHTHALAZINONE DERIVATIVES KUDOS PHARM LTD (GB) 2011-05-04 EP disclosed
US-20110034469-A1 Heterocyclic Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-02-10 US disclosed
US-20100197630-A1 CETP INHIBITORS DERIVED FROM BENZOXAZOLE ARYLAMIDES MERCK & CO., INC 2010-08-05 US disclosed
US-20100179140-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2010-07-15 US disclosed
US-20100121049-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2010-05-13 US disclosed
CN-101583352-A Preparation and use of biphenyl amino acid derivatives for the treatment of obesity BAYER PHARMACEUTICALS CORP (US) 2009-11-18 CN disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 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 (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-20110034469-A1 Heterocyclic Compound BIRC5, XIAP, BIRC2 CA14 2123/4885CA12 1353/4885SMN1; SMN2 672/4885
US-20250051306-A1 RAS INHIBITORS KRAS, NRAS, HRAS CA14 3948/4885CA12 4023/4885SMN1; SMN2 3728/4885
US-20250195521-A1 USE OF SOS1 INHIBITORS TO TREAT MALIGNANCIES WITH SHP2 MUTATIONS SOS1, PPM1D, PTPN1 CA14 4556/4885CA12 4480/4885SMN1; SMN2 986/4885
US-20250136577-A1 HETEROCYCLIC DERIVATIVES AS MALT1 INHIBITORS MALT1, SQSTM1, FKBP1A CA14 3793/4885CA12 3526/4885SMN1; SMN2 2480/4885
US-20140235789-A1 SOLID PHASE PEPTIDE SYNTHESIS VIA SIDE CHAIN ATTACHMENT HDGF, VIP, HDGFL3 CA14 3325/4885CA12 3320/4885SMN1; SMN2 3462/4885
US-20100121049-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF TNNI3, IDH2, GLS CA14 4836/4885CA12 4746/4885SMN1; SMN2 18/4885
US-20100179140-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF TNNI3, IDH2, GLS CA14 4836/4885CA12 4746/4885SMN1; SMN2 18/4885
US-20100197630-A1 CETP INHIBITORS DERIVED FROM BENZOXAZOLE ARYLAMIDES CETP, APOB, MTTP CA14 4504/4885CA12 4651/4885SMN1; SMN2 4789/4885
US-12384790-B2 Pteridinone compounds and uses thereof DPYD, PKD1, TYMP CA14 4431/4885CA12 4350/4885SMN1; SMN2 1711/4885

“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.