SCHEMBL5154685

SCHEMBL5154685

COc1ccc2c(c1)CCC1C2CC[C@]2(C)C=CCC12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.64
HSD17B1 P14061 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
MAPT P10636 1/20 0.64
RECQL P46063 1/20 0.64
HSD17B10 Q99714 1/20 0.62
ESR1 P03372 5/20 0.58
PGR P06401 2/20 0.58
SLC6A3 Q01959 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C19 P33261 1/20 0.58
HIF1A Q16665 1/20 0.58
NR3C1 P04150 1/20 0.58
CNR1 P21554 1/20 0.58
SLC6A2 P23975 1/20 0.58
SLC6A4 P31645 1/20 0.58
STS P08842 6/20 0.49
ABCC4 O15439 2/20 0.48
ABCC1 P33527 2/20 0.48

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
SCHEMBL1246984 1.00 LMNA (0.64) LMNAHSD17B1SMN1; SMN2MAPTRECQL
SCHEMBL5682148 1.00 LMNA (0.64) LMNAHSD17B1SMN1; SMN2MAPTRECQL
SCHEMBL5679838 1.00 LMNA (0.64) LMNAHSD17B1SMN1; SMN2MAPTRECQL
SCHEMBL5679791 1.00 LMNA (0.64) LMNAHSD17B1SMN1; SMN2MAPTRECQL
Methoxymethane SCHEMBL4279943 0.86 ESR1 (0.60) LMNAHSD17B1SMN1; SMN2MAPTRECQL
SCHEMBL4284331 0.86 LMNA (0.67) LMNAHSD17B1SMN1; SMN2MAPTRECQL
SCHEMBL1246985 0.86 LMNA (0.67) LMNAHSD17B1SMN1; SMN2MAPTRECQL
Potassium Ion SCHEMBL6238010 0.86 KDM4E (0.68) LMNAHSD17B1SMN1; SMN2MAPTRECQL
Potassium Ion SCHEMBL6238005 0.86 KDM4E (0.68) LMNAHSD17B1SMN1; SMN2MAPTRECQL
SCHEMBL7867608 0.84 ESR1 (0.63) LMNAHSD17B1SMN1; SMN2MAPTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6331534-B1 ADMINISTERING EFFECTIVE AMOUNT OF STEROID WITHIN NASAL PASSAGE OF INDIVIDUAL SUCH THAT IT BINDS SPECIFICALLY TO RECEPTORS ON SURFACE OF NASAL NEUROEPITHELIAL CELLS IN VOMERONASAL ORGAN PHERIN PHARMACEUTICALS, INC. 2001-12-18 US claimed
US-8431559-B2 Treatment of hot flashes PHERIN PHARMACEUTICALS, INC. (US) 2013-04-30 US disclosed
US-20120108558-A1 Treatment of Hot Flashes PHERIN PHARMACEUTICALS, INC. 2012-05-03 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-A1 17-METHYLENE-ANDROSTAN-3a-OL ANALOGS AS CRH INHIBITORS Pherin Pharmaceuticals, Inc. (US) 2004-03-03 EP disclosed
EP-0830369-B1 NOR-PREGNANES FOR INDUCING HYPOTHALAMIC EFFECTS PHERIN PHARM INC (US) 2003-05-14 EP 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
US-6432938-B1 NASAL ADMINISTERING A STEROID PHERIN CORPORATION 2002-08-13 US disclosed
US-6331534-B1 ADMINISTERING EFFECTIVE AMOUNT OF STEROID WITHIN NASAL PASSAGE OF INDIVIDUAL SUCH THAT IT BINDS SPECIFICALLY TO RECEPTORS ON SURFACE OF NASAL NEUROEPITHELIAL CELLS IN VOMERONASAL ORGAN PHERIN PHARMACEUTICALS, INC. 2001-12-18 US disclosed
US-6117860-A NASALLY ADMINISTERING STEROID WHICH BINDS TO A SPECIFIC NEUROEPITHELIAL RECEPTOR FOR ALLEVIATING PREMENSTRUAL TENSION AND ANXIETY PHERIN PHARMACEUTICALS, INC. (US) 2000-09-12 US disclosed
US-6057439-A EPOXYSTEROIDS PHERIN CORPORATION (US) 2000-05-02 US disclosed
US-5962443-A 19-nur-pregnane steroids as neurochemical initiators of change in human hypothalamic function PHERIN CORPORATION (US) 1999-10-05 US disclosed
US-5922699-A AFFECTING CERTAIN CONSEQUENT BEHAVIOR AND PHYSIOLOGY, E.G., THE REDUCTION OF ANXIETY PHERIN CORPORATION (US) 1999-07-13 US disclosed
WO-1996040727-A9 NOVEL NOR-PREGNANES FOR INDUCING HYPOTHALAMIC EFFECTS 1997-01-30 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 (2 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-20120108558-A1 Treatment of Hot Flashes HSD17B11, HSD3B1, HSD3B2 LMNA 3777/4885HSD17B1 13/4885SMN1; SMN2 4176/4885
US-20030045514-A1 17-Methyleneandrostan-3alpha-ol analogs as CRH inhibitors CRH, CRHR1, CRHR2 LMNA 4118/4885HSD17B1 9/4885SMN1; SMN2 4073/4885

“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.