SCHEMBL1612723

SCHEMBL1612723

C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@](Cl)(OP(=O)(O)O)c1ccnc2ccc(OC)cc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 7/20 0.60
KDM4E B2RXH2 8/20 0.58
ALDH1A1 P00352 5/20 0.58
SLC22A1 O15245 3/20 0.58
ABCB11 O95342 3/20 0.58
ABCB1 P08183 3/20 0.58
ADRA2A P08913 3/20 0.58
SLC6A4 P31645 3/20 0.58
OPRM1 P35372 3/20 0.58
SCN1A P35498 3/20 0.58
KCNH2 Q12809 3/20 0.58
SCN2A Q99250 3/20 0.58
SCN3A Q9NY46 3/20 0.58
CYP3A4 P08684 3/20 0.58
HSD17B10 Q99714 3/20 0.58
SLC22A2 O15244 2/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
THRB P10828 1/20 0.58
ABCC4 O15439 1/20 0.58

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
SCHEMBL9614099 0.94 CYP2D6 (0.57) CYP2D6KDM4EALDH1A1SLC22A1ABCB11
SCHEMBL4305 0.90 CYP2D6 (0.63) CYP2D6KDM4EALDH1A1SLC22A1ABCB11
Sulfuric Acid SCHEMBL19100311 0.88 KDM4E (0.66) CYP2D6KDM4EALDH1A1SLC22A1ABCB11
SCHEMBL669873 0.86 CYP2D6 (0.64) CYP2D6KDM4EALDH1A1SLC22A1ABCB11
SCHEMBL22862890 0.84 KDM4E (0.66) CYP2D6KDM4EALDH1A1SLC22A1ABCB11
SCHEMBL15239796 0.82 KDM4E (0.64) CYP2D6KDM4EALDH1A1SLC22A1ABCB11
SCHEMBL4278098 0.81 CYP2D6 (0.65) CYP2D6KDM4EALDH1A1SLC22A1ABCB11
Sulfuric Acid SCHEMBL9614123 0.81 KDM4E (0.67) CYP2D6KDM4EALDH1A1SLC22A1ABCB11
SCHEMBL2150774 0.80 KDM4E (0.61) CYP2D6KDM4EALDH1A1SLC22A1ABCB11
SCHEMBL789401 0.80 KDM4E (0.59) CYP2D6KDM4EALDH1A1SLC22A1ABCB11

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260048071-A1 12-LIPOXYGENASE INHIBITORS FOR THE TREATMENT OF LUPUS Cadrenal Therapeutics, Inc. 2026-02-19 US disclosed
EP-4615432-A2 12-LIPOXYGENASE INHIBITORS FOR THE TREATMENT OF LUPUS Veralox Therapeutics Inc. (US) 2025-09-17 EP disclosed
WO-2024103023-A2 12-LIPOXYGENASE INHIBITORS FOR THE TREATMENT OF LUPUS VERALOX THERAPEUTICS (US) 2024-05-16 WO disclosed
US-20160058749-A1 TREATMENTS FOR NEUROPATHY CHILDRENS MEDICAL CENTER (US) 2016-03-03 US disclosed
US-20160045487-A1 COMPOSITIONS AND METHODS FOR TREATING NEUROPATHY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-02-18 US disclosed
WO-2014160811-A1 COMPOSITIONS AND METHODS FOR TREATING NEUROPATHY CHILDREN'S MEDICAL CENTER CORPORATION (US) 2014-10-02 WO disclosed
US-20110086878-A1 Treatments for Neuropathy NIH-DEITR 2011-04-14 US disclosed
US-7863295-B2 Treatments for neuropathy CHILDREN'S MEDICAL CENTER CORPORATION (US) 2011-01-04 US disclosed
EP-2240177-A2 TREATMENTS FOR NEUROPATHY Children's Medical Center Corporation (US) 2010-10-20 EP disclosed
US-20090297478-A1 Methods and Compositions for the Treatment of Lupus Using Clofarabine WOOD CHRISTOPHER B 2009-12-03 US disclosed
WO-2009102570-A2 TREATMENTS FOR NEUROPATHY CHILDREN'S MEDICAL CENTER CORPORATION (US) 2009-08-20 WO disclosed
US-20090203735-A1 TREATMENTS FOR NEUROPATHY NIH-DEITR 2009-08-13 US disclosed
EP-1551386-A4 METHODS AND COMPOSITIONS FOR THE TREATMENT OF LUPUS USING CLOFARABINE BIOENVISION INC (US) 2009-03-25 EP disclosed
US-20060135463-A1 Methods and compositions for the treatment of lupus using clofarabine WOOD CHRISTOPHER B 2006-06-22 US disclosed
WO-2006007312-A2 CO-ADMINISTRATION OF DEHYDROEPIANDROSTERONE (DHEA) CONGENER WITH PHARMACEUTICALLY ACTIVE AGENTS FOR TREATING INFLAMMATION INFLABLOC PHARMACEUTICALS, INC. (US) 2006-01-19 WO disclosed
US-20060004076-A1 Co-administration of dehydroepiandrosterone (DHEA) congener with pharmaceutically active agents for treating inflammation INFLABLOC PHARMACEUTICALS, INC. 2006-01-05 US disclosed
EP-1551386-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF LUPUS USING CLOFARABINE Bioenvision, Inc. (US) 2005-07-13 EP disclosed
WO-2004028463-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF LUPUS USING CLOFARABINE BIOENVISION, INC. (US) 2004-04-08 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 (8 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-20060004076-A1 Co-administration of dehydroepiandrosterone (DHEA) congener with pharmaceutically active agents for treating inflammation CYP17A1, CYP21A2, SHBG CYP2D6 81/4885KDM4E 3586/4885ALDH1A1 236/4885
US-20090297478-A1 Methods and Compositions for the Treatment of Lupus Using Clofarabine SSB, BCL9, IL2 CYP2D6 1126/4885KDM4E 1933/4885ALDH1A1 1996/4885
US-20160058749-A1 TREATMENTS FOR NEUROPATHY NGF, BDNF, NTRK2 CYP2D6 3450/4885KDM4E 4167/4885ALDH1A1 358/4885
US-20090203735-A1 TREATMENTS FOR NEUROPATHY NGF, BDNF, NTRK2 CYP2D6 3450/4885KDM4E 4167/4885ALDH1A1 358/4885
US-20060135463-A1 Methods and compositions for the treatment of lupus using clofarabine SSB, BCL9, IL2 CYP2D6 1126/4885KDM4E 1933/4885ALDH1A1 1996/4885
US-20260048071-A1 12-LIPOXYGENASE INHIBITORS FOR THE TREATMENT OF LUPUS ALOX12, ALOX5, ALOX15 CYP2D6 87/4885KDM4E 1329/4885ALDH1A1 613/4885
US-20160045487-A1 COMPOSITIONS AND METHODS FOR TREATING NEUROPATHY PMP22, GAP43, NGF CYP2D6 4821/4885KDM4E 2932/4885ALDH1A1 3005/4885
US-20110086878-A1 Treatments for Neuropathy NGF, BDNF, NTRK2 CYP2D6 3450/4885KDM4E 4167/4885ALDH1A1 358/4885

“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.