SCHEMBL1538258

SCHEMBL1538258

CC(C)(C)C(=O)Oc1cccc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.60
▸ HSD17B10 Q99714 3/20 0.60
▸ GAA P10253 2/20 0.60
▸ PGR P06401 1/20 0.60
▸ PTGS1 P23219 1/20 0.60
▸ MAPK1 P28482 1/20 0.60
▸ ELANE P08246 2/20 0.59
▸ KDM4E B2RXH2 3/20 0.58
▸ KMT2A Q03164 3/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ HPGD P15428 2/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ MMP2 P08253 1/20 0.48
▸ FABP7 O15540 4/20 0.47
▸ FABP3 P05413 4/20 0.47
▸ FABP5 Q01469 4/20 0.47
▸ BCHE P06276 1/20 0.47
▸ SLC6A3 Q01959 1/20 0.47

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
SCHEMBL31748924 1.00 ALDH1A1 (0.60) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL10804065 0.87 ELANE (0.53) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL12128703 0.86 ALDH1A1 (0.57) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL7737365 0.86 ALDH1A1 (0.57) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL29080821 0.85 ELANE (0.54) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL11991243 0.83 ALDH1A1 (0.54) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL7265465 0.83 ALDH1A1 (0.54) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL16237325 0.83 MAPT (0.53) ALDH1A1HSD17B10ELANEKDM4E
SCHEMBL29607284 0.82 ELANE (0.74) ALDH1A1ELANE
SCHEMBL28221287 0.82 ALDH1A1 (0.53) ALDH1A1HSD17B10GAAPGRPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12398154-B2 Azaquinazoline pan-KRas inhibitors Mirati Therapeutics, Inc. (US) 2025-08-26 — — US disclosed
US-20230072276-A1 Azaquinazoline pan-KRas inhibitors Mirati Therapeutics, Inc. 2023-03-09 — — US disclosed
US-10173980-B2 Mixed disulfide conjugates of thienopyridine compounds and uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2019-01-08 — — US disclosed
US-20180155289-A1 MIXED DISULFIDE CONJUGATES OF THIENOPYRIDINE COMPOUNDS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2018-06-07 — — US disclosed
US-20180155289-A1 MIXED DISULFIDE CONJUGATES OF THIENOPYRIDINE COMPOUNDS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2018-06-07 — — US disclosed
EP-2157143-B1 NONAQUEOUS INKJET INK COMPOSITION DAINIPPON TORYO KK (JP) 2017-03-08 — — EP disclosed
EP-2774923-B1 METHOD FOR PRODUCING PHENYL-SUBSTITUTED HETEROCYCLIC DERIVATIVE UNIV NAGOYA NAT UNIV CORP (JP) 2016-05-18 — — EP disclosed
EP-2774923-B1 METHOD FOR PRODUCING PHENYL-SUBSTITUTED HETEROCYCLIC DERIVATIVE UNIV NAGOYA NAT UNIV CORP (JP) 2016-05-18 — — EP disclosed
US-20160074853-A1 LIGAND, NICKEL COMPLEX COMPRISING THE LIGAND, AND REACTION USING THE NICKEL COMPLEX NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2016-03-17 — — US disclosed
CN-104744186-A Method for catalytic synthesis of biaryl compound by utilizing nickel catalyst UNIV CAS 2015-07-01 — — CN disclosed
US-20100056679-A1 NON-AQUEOUS INK JET INK COMPOSITION DAI NIPPON TORYO CO., LTD. (JP) 2010-03-04 — — US disclosed
CN-101661233-A Method for producing toner, two-component developer, developing device and image forming apparatus SHARP KK 2010-03-03 — — CN disclosed
EP-2157143-A1 NONAQUEOUS INKJET INK COMPOSITION Dai Nippon Toryo Co., Ltd. (JP) 2010-02-24 — — EP disclosed
CN-101652436-A Nonaqueous inkjet ink composition DAINIPPON TORYO KK JP 2010-02-17 — — CN disclosed
CN-100504625-C Toner for electrostatic image development and process for preparing the same SHARP KK (JP) 2009-06-24 — — CN disclosed
US-7342016-B2 Farnesyl protein transferase inhibitors as antitumor agents SCHERING CORPORATION (US) 2008-03-11 — — US disclosed
US-20070138139-A1 METHOD OF MANUFACTURING SEMICONDUCTOR DEVICE, ACID ETCHING RESISTANCE MATERIAL AND COPOLYMER ASAKAWA KOJI 2007-06-21 — — US disclosed
US-20070142592-A1 METHOD OF MANUFACTURING SEMICONDUCTOR DEVICE, ACID ETCHING RESISTANCE MATERIAL AND COPOLYMER ASAKAWA KOJI 2007-06-21 — — US disclosed
US-7208334-B2 Method of manufacturing semiconductor device, acid etching resistance material and copolymer KABUSHIKI KAISHA TOSHIBA (JP) 2007-04-24 — — US disclosed
CN-1847988-A Toner for electrostatic image development and process for preparing the same SHARP KK (JP) 2006-10-18 — — CN 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-20160074853-A1 LIGAND, NICKEL COMPLEX COMPRISING THE LIGAND, AND REACTION USING THE NICKEL COMPLEX NISCH, DDT, TEC ALDH1A1 2430/4885HSD17B10 2678/4885GAA 3088/4885
US-10173980-B2 Mixed disulfide conjugates of thienopyridine compounds and uses thereof TST, TXN, TXNRD2 ALDH1A1 218/4885HSD17B10 1284/4885GAA 3663/4885
US-20180155289-A1 MIXED DISULFIDE CONJUGATES OF THIENOPYRIDINE COMPOUNDS AND USES THEREOF TST, TXN, TXNRD2 ALDH1A1 218/4885HSD17B10 1284/4885GAA 3663/4885
US-20230072276-A1 Azaquinazoline pan-KRas inhibitors KRAS, NRAS, HRAS ALDH1A1 4127/4885HSD17B10 4758/4885GAA 3182/4885
US-12398154-B2 Azaquinazoline pan-KRas inhibitors KRAS, NRAS, HRAS ALDH1A1 4127/4885HSD17B10 4758/4885GAA 3182/4885

“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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