SCHEMBL2970804

SCHEMBL2970804

Cc1cccc(C2CN(C)CCc3c2cc(O)c(O)c3Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 16/20 1.00
▸ KDM4E B2RXH2 5/20 1.00
▸ MAPT P10636 3/20 1.00
▸ PMP22 Q01453 3/20 1.00
▸ TSHR P16473 3/20 1.00
▸ HSD17B10 Q99714 3/20 1.00
▸ ADRA2A P08913 2/20 1.00
▸ CYP2D6 P10635 2/20 1.00
▸ THPO P40225 2/20 1.00
▸ MTOR P42345 2/20 1.00
▸ MEN1 O00255 1/20 1.00
▸ CYP1A2 P05177 1/20 1.00
▸ CYP3A4 P08684 1/20 1.00
▸ KMT2A Q03164 1/20 1.00
▸ ALOX15 P16050 2/20 0.81
▸ NFKB1 P19838 1/20 0.81
▸ HIF1A Q16665 1/20 0.81
▸ MAPK1 P28482 2/20 0.80
▸ LMNA P02545 1/20 0.80
▸ DRD2 P14416 9/20 0.79

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
SCHEMBL30231809 1.00 DRD1 (1.00) DRD1KDM4EMAPTPMP22TSHR
SCHEMBL30026797 1.00 DRD1 (1.00) DRD1KDM4EMAPTPMP22TSHR
Bromide SCHEMBL29634914 0.99 DRD1 (1.00) DRD1KDM4EMAPTPMP22TSHR
Bromide SCHEMBL12610614 0.99 DRD1 (1.00) DRD1KDM4EMAPTPMP22TSHR
SCHEMBL14510734 0.90 DRD1 (0.81) DRD1KDM4EMAPTPMP22TSHR
SCHEMBL7323497 0.88 DRD1 (1.00) DRD1KDM4EMAPTPMP22TSHR
Bromide SCHEMBL29634894 0.87 DRD1 (1.00) DRD1KDM4EMAPTPMP22TSHR
Bromide SCHEMBL7320300 0.87 DRD1 (1.00) DRD1KDM4EMAPTPMP22TSHR
SCHEMBL34464664 0.87 DRD1 (0.80) DRD1KDM4EMAPTPMP22TSHR
SCHEMBL14495044 0.84 DRD1 (0.72) DRD1KDM4EMAPTPMP22TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4523686-A1 A SIGMA-1 RECEPTOR POSITIVE MODULATOR FOR ITS USE IN THE PREVENTION AND THE TREATMENT OF A PATHOLOGY UNIVERSITE DE MONTPELLIER (FR) 2025-03-19 — — EP disclosed
WO-2023006412-A1 SIGMA-1 RECEPTOR ACTIVATOR FOR USE IN THE TREATMENT OF A PATHOLOGY ASSOCIATED WITH WFS1 MUTATION UNIVERSITÉ DE MONTPELLIER (FR) 2023-02-02 — — WO disclosed
EP-4124338-A1 SIGMA-1 RECEPTOR ACTIVATOR FOR USE IN THE TREATMENT OF A PATHOLOGY ASSOCIATED WITH WFS1 MUTATION Université de Montpellier (FR) 2023-02-01 — — EP disclosed
US-20200164068-A1 MODULATORS OF TUMOR IMMUNE RESISTANCE FOR THE TREATMENT OF CANCER Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2020-05-28 — — US disclosed
US-20190054110-A1 MODULATORS OF CCR9 FOR TREATING TUMOR RESISTANCE TO IMMUNE RESPONSES Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2019-02-21 — — US disclosed
EP-3416641-A1 MODULATORS OF CCR9 FOR TREATING TUMOR RESISTANCE TO IMMUNE RESPONSES Deutsches Krebsforschungszentrum Stiftung des Öffentlichen Rechts (DE) 2018-12-26 — — EP disclosed
EP-3416640-A1 MODULATORS OF TUMOR IMMUNE RESISTANCE FOR THE TREATMENT OF CANCER Deutsches Krebsforschungszentrum Stiftung des Öffentlichen Rechts (DE) 2018-12-26 — — EP disclosed
WO-2017140803-A1 MODULATORS OF TUMOR IMMUNE RESISTANCE FOR THE TREATMENT OF CANCER Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2017-08-24 — — WO disclosed
WO-2017140793-A1 MODULATORS OF CCR9 FOR TREATING TUMOR RESISTANCE TO IMMUNE RESPONSES Deutsches Krebsforschungszentrum Stiftung des öffentlichen Rechts (DE) 2017-08-24 — — WO disclosed
US-9593360-B2 Measurement of brain CDP-diacylglycerol synthase 1 enzyme and uses thereof UNDIEH ASHIWEL S (US) 2017-03-14 — — US disclosed
US-20160317474-A1 Managing Visual Dysfunction or Loss of Vision for Diabetic Subjects UNIV EMORY (US) 2016-11-03 — — US disclosed
WO-2015095257-A2 MANAGING VISUAL DYSFUNCTION OR LOSS OF VISION FOR DIABETIC SUBJECTS EMORY UNIVERSITY (US) 2015-06-25 — — WO disclosed
US-20130022978-A1 Measurement of Brain CDP-Diacylglycerol Synthase 1 Enzyme and Uses Thereof UNDIEH ASHIWEL S (US) 2013-01-24 — — US disclosed
US-8278296-B2 Manipulation of brain CDP-diacylglycerol and uses thereof UNDIEH ASHIWEL S (US) 2012-10-02 — — US disclosed
US-20100311728-A1 Manipulation of brain CDP-diacylglycerol and uses thereof UNDIEH ASHIWEL S 2010-12-09 — — US disclosed
US-7763603-B2 Manipulation of brain CDP-diacylglycerol and uses thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-07-27 — — US disclosed
US-20080039443-A1 Manipulation of brain CDP-diacylglycerol and uses thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-02-14 — — US disclosed
US-20070142399-A1 Dual function drugs and uses thereof PSYCHIATRIC GENOMICS, INC. (US) 2007-06-21 — — US disclosed
US-20070142399-A1 Dual function drugs and uses thereof PSYCHIATRIC GENOMICS, INC. (US) 2007-06-21 — — US 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 (1 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-20070142399-A1 Dual function drugs and uses thereof COMT, DRD2, SLC6A3 DRD1 6/4885KDM4E 3362/4885MAPT 1230/4885

“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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