SCHEMBL7752373

SCHEMBL7752373

CC(C)(C)NCCc1ccccn1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.65
ALDH1A1 P00352 4/20 0.62
LMNA P02545 2/20 0.62
TAAR1 Q96RJ0 1/20 0.62
ALOX15 P16050 1/20 0.62
CYP1A2 P05177 4/20 0.56
CYP2C19 P33261 1/20 0.56
TDP1 Q9NUW8 1/20 0.54
HRH1 P35367 1/20 0.50
NPSR1 Q6W5P4 1/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
APP P05067 2/20 0.48
CYP2D6 P10635 1/20 0.46

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
SCHEMBL22851320 0.89 HRH3 (0.56) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL22851381 0.88 HRH3 (0.54) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL7749926 0.82 MAOA (0.55) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL31385340 0.82 MAOA (0.55) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL746674 0.79 CYP1A2 (0.67) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL14354975 0.79 ALDH1A1 (0.61) HRH3ALDH1A1LMNATAAR1ALOX15
Betahistine SCHEMBL125582 0.79 HRH3 (1.00) HRH3ALDH1A1LMNATAAR1ALOX15
SCHEMBL11076804 0.79 HRH3 (0.66) HRH3ALDH1A1LMNATAAR1ALOX15
Betahistine SCHEMBL29354603 0.79 HRH3 (1.00) HRH3ALDH1A1LMNATAAR1ALOX15
Betahistine SCHEMBL28346535 0.79 HRH3 (1.00) HRH3ALDH1A1LMNATAAR1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685722-B2 Inhibition of Olig2 activity Curtana Pharmaceuticals, Inc. (US) 2023-06-27 US disclosed
US-11685722-B2 Inhibition of Olig2 activity Curtana Pharmaceuticals, Inc. (US) 2023-06-27 US disclosed
US-11242323-B2 Inhibition of OLIG2 activity Curtana Pharmaceuticals, Inc. (US) 2022-02-08 US disclosed
US-11198705-B2 Hybrid Amphotericin B derivatives with reduced toxicity THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-12-14 US disclosed
US-20210253535-A1 INHIBITION OF OLIG2 ACTIVITY Curtana Pharmaceuticals, Inc. 2021-08-19 US disclosed
US-10882883-B2 Derivatives of amphotericin B SFUNGA THERAPEUTICS, INC. (US) 2021-01-05 US disclosed
US-20200407329-A1 INHIBITION OF OLIG2 ACTIVITY Curtana Pharmaceuticals, Inc. 2020-12-31 US disclosed
US-20200262858-A1 DERIVATIVES OF AMPHOTERICIN B ELION THERAPEUTICS, INC. 2020-08-20 US disclosed
US-20190233441-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2019-08-01 US disclosed
US-9957290-B2 Derivatives of amphotericin B SFUNGA THERAPEUTICS, INC. (US) 2018-05-01 US disclosed
US-7282608-B2 Inhibitors of histone deacetylase METHYLGENE, INC. (CA) 2007-10-16 US disclosed
US-20070149560-A1 Novel fused triazolones and the uses thereof ASTRAZENECA AB (SE) 2007-06-28 US disclosed
US-20070149560-A1 Novel fused triazolones and the uses thereof ASTRAZENECA AB (SE) 2007-06-28 US disclosed
US-7235541-B2 Neurokinin antagonists for use as medicaments ASTRAZENECA AB (SE) 2007-06-26 US disclosed
US-7235541-B2 Neurokinin antagonists for use as medicaments ASTRAZENECA AB (SE) 2007-06-26 US disclosed
US-20070054933-A1 17-Heterocyclic-4-azasteroid derivatives as androgen receptor modulators MERCK & CO., INC (US) 2007-03-08 US disclosed
US-20070021406-A1 New neurokinin antagonists for use as medicaments ASTRAZENECA AB (SE) 2007-01-25 US disclosed
US-20070021406-A1 New neurokinin antagonists for use as medicaments ASTRAZENECA AB (SE) 2007-01-25 US disclosed
US-7160890-B2 Compounds specific to adenosine A3 receptor and uses thereof OSI PHARMACEUTICALS, INC. (US) 2007-01-09 US disclosed
US-6680324-B2 4-AMINO-6-PHENYL-PYRROLO(2,3-D)PYRIMIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2004-01-20 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 (11 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-20210253535-A1 INHIBITION OF OLIG2 ACTIVITY GLI2, ING2, GMFG HRH3 4049/4885ALDH1A1 1478/4885LMNA 4459/4885
US-11685722-B2 Inhibition of Olig2 activity GLI2, ING2, GMFG HRH3 4049/4885ALDH1A1 1478/4885LMNA 4459/4885
US-20070021406-A1 New neurokinin antagonists for use as medicaments NPSR1, HRH4, OPRL1 HRH3 10/4885ALDH1A1 2402/4885LMNA 1265/4885
US-10882883-B2 Derivatives of amphotericin B C9, ERG28, AMPD3 HRH3 653/4885ALDH1A1 2372/4885LMNA 2238/4885
US-20070149560-A1 Novel fused triazolones and the uses thereof TP53, BRCA1, KLK3 HRH3 3088/4885ALDH1A1 1270/4885LMNA 3065/4885
US-20190233441-A1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF ABL1, JAK2, JAK1 HRH3 1610/4885ALDH1A1 1339/4885LMNA 3763/4885
US-20200262858-A1 DERIVATIVES OF AMPHOTERICIN B C9, ERG28, AMPD3 HRH3 653/4885ALDH1A1 2372/4885LMNA 2238/4885
US-11242323-B2 Inhibition of OLIG2 activity POU2F2, ING2, PAX2 HRH3 3112/4885ALDH1A1 1801/4885LMNA 4437/4885
US-20070054933-A1 17-Heterocyclic-4-azasteroid derivatives as androgen receptor modulators AR, SHBG, NR5A1 HRH3 2042/4885ALDH1A1 1800/4885LMNA 2668/4885
US-11198705-B2 Hybrid Amphotericin B derivatives with reduced toxicity ERG28, BAK1, MCL1 HRH3 1864/4885ALDH1A1 1987/4885LMNA 2325/4885
US-20200407329-A1 INHIBITION OF OLIG2 ACTIVITY GLI2, ING2, GMFG HRH3 4049/4885ALDH1A1 1478/4885LMNA 4459/4885

“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.