SCHEMBL3605272

SCHEMBL3605272

CN1CCCC(C)(CO)C1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.36
EPHX1 P07099 1/20 0.34
VNN1 O95497 1/20 0.33
CYP2D6 P10635 2/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
EHMT2 Q96KQ7 1/20 0.31
SLC22A1 O15245 1/20 0.30
CHRM2 P08172 1/20 0.30
ACHE P22303 1/20 0.30
SLC6A4 P31645 1/20 0.30
OPRM1 P35372 1/20 0.30

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
SCHEMBL25467291 0.94 SLC22A1 (0.36) USP2EPHX1CYP2D6SLC22A1CHRM2
SCHEMBL6625522 0.86
SCHEMBL19045071 0.86
SCHEMBL19063296 0.83 EPHX1 (0.34) EPHX1EHMT2
SCHEMBL23466099 0.80 SLC22A1 (0.34) USP2CYP2D6SLC22A1CHRM2ACHE
SCHEMBL14413879 0.80 USP2 (0.33) USP2OPRM1
SCHEMBL22421781 0.78 EPHX1 (0.34) EPHX1VNN1
SCHEMBL22663697 0.77 USP2 (0.32) USP2
SCHEMBL23774546 0.76 KMT2A (0.42) USP2CYP2D6CYP2C9TSHRHSD17B10
SCHEMBL26790736 0.76 USP2 (0.33) USP2

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
CN-113933432-B High-sensitivity and high-precision analysis method suitable for detecting alkaloid in tobacco leaves 中国烟草总公司郑州烟草研究院 2023-08-25 CN claimed
US-20260001838-A1 NANOMATERIALS GUIDE THERAPEUTICS LLC (US) 2026-01-01 US disclosed
US-12435035-B2 Nanomaterials GUIDE THERAPEUTICS, LLC (US) 2025-10-07 US disclosed
EP-4596551-A1 COMPOUNDS WITH ANTI-KRAS MUTANT TUMOR ACTIVITY Trasveda Ltd. (KY) 2025-08-06 EP disclosed
CN-119684140-A Nanomaterial for the preparation of a nanoparticle 盖德治疗有限责任公司 2025-03-25 CN disclosed
WO-2024259169-A1 PYRIMIDINE BASED MODULATORS AND USES THEREOF QUANTA THERAPEUTICS, INC. (US) 2024-12-19 WO disclosed
CN-115175894-B Nanomaterial for the preparation of a nanoparticle 盖德治疗有限责任公司 2024-09-06 CN disclosed
WO-2024067714-A1 COMPOUNDS WITH ANTI-KRAS MUTANT TUMOR ACTIVITY 泰励生物科技(上海)有限公司 2024-04-04 WO disclosed
CN-117800975-A Compounds with anti-KRAS mutant tumor activity 泰励生物科技(上海)有限公司 2024-04-02 CN disclosed
CN-113933432-B High-sensitivity and high-precision analysis method suitable for detecting alkaloid in tobacco leaves 中国烟草总公司郑州烟草研究院 2023-08-25 CN disclosed
US-7932259-B2 Pyrrolo[2,3-d]pyrimidine derivatives substituted with a cyclic amino group TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-04-26 US disclosed
US-7723331-B2 Thienopyrimidine compounds and uses thereof ASTRAZENECA AB (SE) 2010-05-25 US disclosed
EP-2121703-A1 THIENOPYRIMIDIN-4-ONE AND THIENOPYRIDAZIN-7-ONE DERIVATIVES AS MCH RL ANTAGONISTS AstraZeneca AB (SE) 2009-11-25 EP disclosed
CN-101528751-A Thienopyrimidin-4-one and thienopyridazin-7-one derivatives as MCH Rl antagonists ASTRAZENECA AB (SE) 2009-09-09 CN disclosed
US-20080287397-A1 Pyrrolopyrimidine Derivatives Substituted with Cyclic Amino Group TASHO PHARMACEUTICAL CO., LTD. (JP) 2008-11-20 US disclosed
US-20080287397-A1 Pyrrolopyrimidine Derivatives Substituted with Cyclic Amino Group TASHO PHARMACEUTICAL CO., LTD. (JP) 2008-11-20 US disclosed
EP-1987827-A1 NOVEL PHARMACEUTICAL Takeda Pharmaceutical Company Limited (JP) 2008-11-05 EP disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US disclosed
WO-2008020799-A1 THIENOPYRIMIDIN-4-ONE AND THIENOPYRIDAZIN-7-ONE DERIVATIVES AS MCH RL ANTAGONISTS ASTRAZENECA AB (SE) 2008-02-21 WO disclosed
EP-1787992-A1 Pyrrolopyrimidine and pyrrolopyridine derivatives substituted with cyclic amino group TAISHO PHARMACEUTICAL CO., LTD (JP) 2007-05-23 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 (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-20080287397-A1 Pyrrolopyrimidine Derivatives Substituted with Cyclic Amino Group HRH2, HRH4, CRHR1 USP2 3450/4885EPHX1 884/4885VNN1 3473/4885
US-20080051405-A1 Therapeutic Agents GPR119, HTT, IAPP USP2 4308/4885EPHX1 1031/4885VNN1 3322/4885
US-20260001838-A1 NANOMATERIALS SLC10A1, NPC1L1, FABP1 USP2 3993/4885EPHX1 1462/4885VNN1 2649/4885
US-12435035-B2 Nanomaterials NPC1, NPC1L1, FABP1 USP2 4124/4885EPHX1 1514/4885VNN1 767/4885

“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.