SCHEMBL918871

SCHEMBL918871

CC(C)[C@@H]1COC(c2cccc(C3=N[C@H](C(C)C)CO3)n2)=N1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.66
MAPT P10636 1/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL245302 1.00 NPC1 (0.66) NPC1MAPTRAB9ASMN1; SMN2MEN1
SCHEMBL31069783 1.00 NPC1 (0.66) NPC1MAPTRAB9ASMN1; SMN2MEN1
SCHEMBL21351775 1.00 NPC1 (0.66) NPC1MAPTRAB9ASMN1; SMN2MEN1
SCHEMBL30106823 1.00 NPC1 (0.66) NPC1MAPTRAB9ASMN1; SMN2MEN1
SCHEMBL14148163 1.00 NPC1 (0.66) NPC1MAPTRAB9ASMN1; SMN2MEN1
SCHEMBL245303 1.00 NPC1 (0.66) NPC1MAPTRAB9ASMN1; SMN2MEN1
SCHEMBL12786269 0.98 NPC1 (0.64) NPC1MAPTRAB9ASMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL7183038 0.97 NPC1 (0.62) NPC1MAPTRAB9ASMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL7171153 0.97 NPC1 (0.62) NPC1MAPTRAB9ASMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL7182624 0.97 NPC1 (0.62) NPC1MAPTRAB9ASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2274294-A1 5-DEMETHOXYFUMAGILLOL AND DERIVATIVES THEREOF Versitech Limited (CN) 2011-01-19 EP claimed
US-20090247503-A1 5-DEMETHOXYFUMAGILLOL AND DERIVATIVES THEREOF VERSITECH LIMITED (CN) 2009-10-01 US claimed
WO-2009117902-A1 5-DEMETHOXYFUMAGILLOL AND DERIVATIVES THEREOF VERSITECH LIMITED (CN) 2009-10-01 WO claimed
US-12497377-B2 Tricyclic spiro compound ONO PHARMACEUTICAL CO., LTD. (JP) 2025-12-16 US disclosed
CN-120865258-A Coumarin-based chiral binary Dy3+Complex enantiomer, preparation method and application thereof 西京学院 2025-10-31 CN disclosed
US-11935803-B2 Resin composition, laminate, semiconductor wafer with resin composition layer, substrate for mounting semiconductor with resin composition layer and semiconductor device MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2024-03-19 US disclosed
US-20230265080-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN VERTEX PHARMA (US) 2023-08-24 US disclosed
US-20230265080-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN VERTEX PHARMA (US) 2023-08-24 US disclosed
CN-112898368-B Preparation method of obeticholic acid intermediate 中国科学院成都有机化学有限公司 2023-08-18 CN disclosed
CN-111039916-B Tricyclic spiro compounds 小野药品工业株式会社 2023-04-28 CN disclosed
CN-114269982-A Fabric coating composition 惠普发展公司,有限责任合伙企业 2022-04-01 CN disclosed
US-20090247503-A1 5-DEMETHOXYFUMAGILLOL AND DERIVATIVES THEREOF VERSITECH LIMITED (CN) 2009-10-01 US disclosed
EP-2095875-A1 Homogeneous asymmetric hydrogenation catalyst Takasago International Corporation (JP) 2009-09-02 EP disclosed
US-20090203927-A1 Homogeneous asymmetric hydrogenation catalyst TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-08-13 US disclosed
US-20080194672-A1 MACROCYCLIC GHRELIN RECEPTOR MODULATORS AND METHODS OF USING THE SAME TRANZYME PHARMA INC. 2008-08-14 US disclosed
US-20080194672-A1 MACROCYCLIC GHRELIN RECEPTOR MODULATORS AND METHODS OF USING THE SAME TRANZYME PHARMA INC. 2008-08-14 US disclosed
EP-1911516-A1 HOMOGENEOUS ASYMMETRIC HYDROGENATION CATALYST Takasago International Corporation (JP) 2008-04-16 EP disclosed
US-20080004242-A1 Process for preparation of HIV protease inhibitors GILEAD SCIENCES, INC. 2008-01-03 US disclosed
US-20080004242-A1 Process for preparation of HIV protease inhibitors GILEAD SCIENCES, INC. 2008-01-03 US disclosed
WO-2007126812-A2 PROCESS FOR PREPARATION OF HIV PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2007-11-08 WO 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 (6 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-20090203927-A1 Homogeneous asymmetric hydrogenation catalyst HDHD5, HHAT, HACL2 NPC1 2029/4885MAPT 3419/4885RAB9A 2049/4885
US-20090247503-A1 5-DEMETHOXYFUMAGILLOL AND DERIVATIVES THEREOF FPGS, DHFR, G6PD NPC1 1716/4885MAPT 2433/4885RAB9A 2027/4885
US-12497377-B2 Tricyclic spiro compound PTGER4, PTGER1, PTGER3 NPC1 577/4885MAPT 4700/4885RAB9A 2518/4885
US-20230265080-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN SERPINA2, SERPINA3, SERPINB1 NPC1 509/4885MAPT 1912/4885RAB9A 3494/4885
US-20080194672-A1 MACROCYCLIC GHRELIN RECEPTOR MODULATORS AND METHODS OF USING THE SAME GHSR, GHRHR, GIPR NPC1 2631/4885MAPT 4766/4885RAB9A 2370/4885
US-20080004242-A1 Process for preparation of HIV protease inhibitors PRSS1, PREP, SERPINB1 NPC1 1225/4885MAPT 2148/4885RAB9A 2334/4885

“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.