SCHEMBL5154339

SCHEMBL5154339

C=C1CC[C@H]2[C@@H]3CCC4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 6/20 0.74
LMNA P02545 5/20 0.74
CYP3A4 P08684 4/20 0.74
SHBG P04278 3/20 0.74
SERPINA6 P08185 3/20 0.74
MEN1 O00255 2/20 0.74
KMT2A Q03164 2/20 0.74
TSHR P16473 2/20 0.74
CYP2C19 P33261 2/20 0.74
G6PD P11413 2/20 0.74
MAPK1 P28482 1/20 0.74
HSD17B3 P37058 1/20 0.74
PMP22 Q01453 1/20 0.74
AKR1B10 O60218 1/20 0.74
AKR1B1 P15121 1/20 0.74
CYP2D6 P10635 1/20 0.74
NFKB1 P19838 1/20 0.74
CYP1A2 P05177 1/20 0.63
CYP2C9 P11712 1/20 0.63
HSD17B10 Q99714 1/20 0.63

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
SCHEMBL3115963 1.00 GPBAR1 (0.74) GPBAR1LMNACYP3A4SHBGSERPINA6
SCHEMBL19750432 1.00 GPBAR1 (0.74) GPBAR1LMNACYP3A4SHBGSERPINA6
SCHEMBL19253221 1.00 GPBAR1 (0.74) GPBAR1LMNACYP3A4SHBGSERPINA6
SCHEMBL5173849 1.00 GPBAR1 (0.74) GPBAR1LMNACYP3A4SHBGSERPINA6
SCHEMBL13302861 1.00 GPBAR1 (0.74) GPBAR1LMNACYP3A4SHBGSERPINA6
SCHEMBL3115971 1.00 GPBAR1 (0.74) GPBAR1LMNACYP3A4SHBGSERPINA6
SCHEMBL1864977 1.00 GPBAR1 (0.74) GPBAR1LMNACYP3A4SHBGSERPINA6
SCHEMBL10060830 1.00 GPBAR1 (0.74) GPBAR1LMNACYP3A4SHBGSERPINA6
Androsterone SCHEMBL23031469 0.85 G6PD (1.00) GPBAR1LMNACYP3A4SHBGSERPINA6
Androsterone SCHEMBL12811704 0.85 G6PD (1.00) GPBAR1LMNACYP3A4SHBGSERPINA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10322138-B2 Treatment of depressive disorders PHERIN PHARMACEUTICALS, INC. (US) 2019-06-18 US disclosed
US-9783592-B2 Glucagon superfamily peptides exhibiting nuclear hormone receptor activity INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2017-10-10 US disclosed
EP-2938346-B1 USE OF PREGN-4-EN-20-YN-3-ONE FOR THE TREATMENT OF DEPRESSIVE DISORDERS PHERIN PHARM INC (US) 2017-04-05 EP disclosed
US-20150320871-A1 Glucagon Superfamily Peptides Exhibiting Nuclear Hormone Receptor Activity UNIV INDIANA RES & TECH CORP (US) 2015-11-12 US disclosed
EP-2938346-A1 USE OF PREGN-4-EN-20-YN-3-ONE FOR THE TREATMENT OF DEPRESSIVE DISORDERS Pherin Pharmaceuticals, Inc. (US) 2015-11-04 EP disclosed
US-20150152187-A1 Anti-PSMA Antibodies Conjugated to Nuclear Receptor Ligand Polypeptides AMBRX, INC. (US) 2015-06-04 US disclosed
WO-2014105620-A1 USE OF PREGN-4-EN-20-YN-3-ONE FOR THE TREATMENT OF DEPRESSIVE DISORDERS PHERIN PHARMACEUTICALS, INC. (US) 2014-07-03 WO disclosed
US-20140187524-A1 Treatment of Depressive Disorders PHERIN PHARMACEUTICALS, INC. (US) 2014-07-03 US disclosed
EP-1392320-B1 17-METHYLENE-ANDROSTAN-3a-OL ANALOGS AS CRH INHIBITORS PHERIN PHARM INC (US) 2007-01-10 EP disclosed
EP-1392320-B1 17-METHYLENE-ANDROSTAN-3a-OL ANALOGS AS CRH INHIBITORS PHERIN PHARM INC (US) 2007-01-10 EP disclosed
EP-1392320-A1 17-METHYLENE-ANDROSTAN-3a-OL ANALOGS AS CRH INHIBITORS Pherin Pharmaceuticals, Inc. (US) 2004-03-03 EP disclosed
EP-1392320-A1 17-METHYLENE-ANDROSTAN-3a-OL ANALOGS AS CRH INHIBITORS Pherin Pharmaceuticals, Inc. (US) 2004-03-03 EP disclosed
US-20030220309-A1 17-methylenandrostan-3alpha-ol analogs as CRH inhibitors PHERIN PHARMACEUTICALS, INC. 2003-11-27 US disclosed
US-20030220309-A1 17-methylenandrostan-3alpha-ol analogs as CRH inhibitors PHERIN PHARMACEUTICALS, INC. 2003-11-27 US disclosed
US-20030220309-A1 17-methylenandrostan-3alpha-ol analogs as CRH inhibitors PHERIN PHARMACEUTICALS, INC. 2003-11-27 US disclosed
US-20030045514-A1 17-Methyleneandrostan-3alpha-ol analogs as CRH inhibitors JULIAN N. STERN, A PROFESSIONAL CORPORATION 2003-03-06 US disclosed
US-20030045514-A1 17-Methyleneandrostan-3alpha-ol analogs as CRH inhibitors JULIAN N. STERN, A PROFESSIONAL CORPORATION 2003-03-06 US disclosed
US-20030045514-A1 17-Methyleneandrostan-3alpha-ol analogs as CRH inhibitors JULIAN N. STERN, A PROFESSIONAL CORPORATION 2003-03-06 US disclosed
WO-2002089814-A1 17-METHYLENE-ANDROSTAN-3α-OL ANALOGS AS CRH INHIBITORS PHERIN PHARMACEUTICALS, INC. (US) 2002-11-14 WO disclosed
WO-2002089814-A1 17-METHYLENE-ANDROSTAN-3α-OL ANALOGS AS CRH INHIBITORS PHERIN PHARMACEUTICALS, INC. (US) 2002-11-14 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-20150320871-A1 Glucagon Superfamily Peptides Exhibiting Nuclear Hormone Receptor Activity GIPR, GLP1R, GCGR GPBAR1 12/4885LMNA 3486/4885CYP3A4 3118/4885
US-10322138-B2 Treatment of depressive disorders HSD3B1, HSD17B3, HSD3B2 GPBAR1 1360/4885LMNA 2137/4885CYP3A4 291/4885
US-20150152187-A1 Anti-PSMA Antibodies Conjugated to Nuclear Receptor Ligand Polypeptides AR, PSMA1, NR2E3 GPBAR1 252/4885LMNA 1671/4885CYP3A4 4372/4885
US-20030220309-A1 17-methylenandrostan-3alpha-ol analogs as CRH inhibitors CRH, CRHR1, CRHR2 GPBAR1 1057/4885LMNA 4606/4885CYP3A4 1627/4885
US-20140187524-A1 Treatment of Depressive Disorders HSD3B1, HSD17B3, HSD3B2 GPBAR1 1360/4885LMNA 2137/4885CYP3A4 291/4885
US-20030045514-A1 17-Methyleneandrostan-3alpha-ol analogs as CRH inhibitors CRH, CRHR1, CRHR2 GPBAR1 798/4885LMNA 4118/4885CYP3A4 810/4885

“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.