SCHEMBL2900733

SCHEMBL2900733

COc1ncnc(OC)c1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.43
ESR1 P03372 1/20 0.38
MAPT P10636 2/20 0.36
CASP1 P29466 1/20 0.35
ALDH1A1 P00352 5/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
RAB9A P51151 2/20 0.35
LMNA P02545 1/20 0.35
PDE5A O76074 1/20 0.34
AURKA O14965 1/20 0.34
TTK P33981 1/20 0.34
AURKB Q96GD4 1/20 0.34
INCENP Q9NQS7 1/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL11475921 0.87 PDPK1 (0.39) PDPK1ESR1MAPTLMNAPDE5A
SCHEMBL1923963 0.84 HTT (0.42) PDPK1ESR1MAPTALDH1A1MEN1
SCHEMBL21611401 0.83 LMNA (0.53) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL21611495 0.82 CYP1A1 (0.44) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL21858763 0.82 TRPA1 (0.50) MAPTCASP1ALDH1A1MEN1KMT2A
SCHEMBL9160539 0.80 CHEK1 (0.38) PDPK1ESR1MAPTALDH1A1LMNA
SCHEMBL21542856 0.80 PDPK1 (0.35) PDPK1ESR1MAPTALDH1A1TSHR
SCHEMBL21611524 0.79 L3MBTL1 (0.46) MAPTMEN1KMT2ARAB9ALMNA
SCHEMBL21611547 0.79 TRPA1 (0.53) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL28514423 0.79 LMNA (0.39) ESR1MAPTALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250381187-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. (US) 2025-12-18 US disclosed
US-12440491-B2 KRAS G12C inhibitors and methods of using the same AMGEN INC. (US) 2025-10-14 US disclosed
US-20250270209-A1 LRRK2 INHIBITORS INTERLINE THERAPEUTICS, INC. 2025-08-28 US disclosed
EP-4522616-A1 LRRK2 INHIBITORS Interline Therapeutics, Inc. (US) 2025-03-19 EP disclosed
CN-119403801-A LRRK2 inhibitors 因特来治疗公司 2025-02-07 CN disclosed
EP-3541804-B1 CYCLOALKYL SUBSTITUTED TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC (US) 2025-01-22 EP disclosed
EP-3541802-B1 ALKYL SUBSTITUTED TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC (US) 2025-01-01 EP disclosed
EP-3532474-B1 4,5-ANNULATED 1,2,4-TRIAZOLONES BAYER AG (DE) 2024-03-27 EP disclosed
US-20240050430-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. 2024-02-15 US disclosed
CN-114921391-B 4, 5-cyclic 1,2, 4-triazolones 拜耳股份有限公司 2024-01-02 CN disclosed
US-5442060-A Treating hyperlipemia, atherosclerosis MITSUBISHI KASEI CORPORATION (JP) 1995-08-15 US disclosed
EP-0591830-A1 Carboxamide and urea derivatives having ACAT-inhibiting activityM Mitsubishi Chemical Corporation (JP) 1994-04-13 EP disclosed
EP-0245687-B1 SUBSTITUTED PYRIMIDINE AMIDES OF OLEIC OR LINOLEIC ACID AS INHIBITORS OF ACYL-COA CHOLESTEROL ACYLTRANSFERASE WARNER-LAMBERT COMPANY (US) 1991-02-27 EP disclosed
US-4722927-A ANTICHOLESTEROL AGENTS WARNER-LAMBERT COMPANY (US) 1988-02-02 US disclosed
EP-0245687-A1 Substituted pyrimidine amides of oleic or linoleic acid as inhibitors of acyl-coa cholesterol acyltransferase WARNER-LAMBERT COMPANY (US) 1987-11-19 EP disclosed
US-4657579-A HERBICIDE SANDOZ LTD. (CH) 1987-04-14 US disclosed
EP-0039037-B1 PYRIMIDYLTHIO-UREAS, MEDICINES CONTAINING THEM AND THEIR USE Beiersdorf Aktiengesellschaft (DE) 1985-01-16 EP disclosed
US-4434167-A Pyrimidyl thioureas useful for the treatment of hypertension and hyperlipidemia BEIERSDORF AKTIENGESELLSCHAFT (DE) 1984-02-28 US disclosed
US-4323570-A HYPOTENSIVE AGENTS AND TREATING GLAUCOMA BEIERSDORF AKTIENGESELLSCHAFT (DE) 1982-04-06 US disclosed
EP-0039037-A1 Pyrimidylthio-ureas, medicines containing them and their use Beiersdorf Aktiengesellschaft (DE) 1981-11-04 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 (4 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-20250381187-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS PDPK1 396/4885ESR1 3463/4885MAPT 4273/4885
US-12440491-B2 KRAS G12C inhibitors and methods of using the same KRAS, NRAS, HRAS PDPK1 396/4885ESR1 3463/4885MAPT 4273/4885
US-20240050430-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS PDPK1 396/4885ESR1 3463/4885MAPT 4273/4885
US-20250270209-A1 LRRK2 INHIBITORS LRRK2, PARK7, PINK1 PDPK1 73/4885ESR1 4528/4885MAPT 14/4885

“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.