SCHEMBL3095680

SCHEMBL3095680

O=C(O)N1CCN(c2ncccc2C(F)(F)F)CC1

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.76
GAA P10253 1/20 0.70
RBP4 P02753 1/20 0.67
TRPV1 Q8NER1 5/20 0.65
TRPA1 O75762 2/20 0.61
EPHX2 P34913 1/20 0.61

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
SCHEMBL6988200 0.87 HSD11B1 (0.70) HSD11B1GAARBP4TRPV1TRPA1
SCHEMBL1375423 0.82 EPHX2 (0.68) HSD11B1GAARBP4TRPV1EPHX2
SCHEMBL3213486 0.82 TRPV1 (0.69) HSD11B1GAARBP4TRPV1TRPA1
SCHEMBL3320963 0.82 HSD11B1 (0.57) HSD11B1GAARBP4TRPV1TRPA1
SCHEMBL4841943 0.82 HSD11B1 (0.63) HSD11B1GAARBP4TRPV1TRPA1
Hydrochloric Acid SCHEMBL1375801 0.81 HSD11B1 (0.65) HSD11B1GAARBP4TRPV1TRPA1
SCHEMBL3222359 0.81 HSD11B1 (0.62) HSD11B1GAARBP4TRPV1TRPA1
SCHEMBL16690887 0.81 RBP4 (1.00) HSD11B1GAARBP4TRPV1TRPA1
SCHEMBL3205429 0.81 GAA (0.64) HSD11B1GAARBP4TRPV1TRPA1
SCHEMBL1252470 0.81 TRPV1 (0.66) HSD11B1GAARBP4TRPV1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023091628-A2 FORMULATIONS AND METHODS FOR TREATING SYMPTOMS OF MENOPAUSE PG13 LAUNCHPAD ALPHA, INC. DBA KINDRA (US) 2023-05-25 WO claimed
WO-2007090134-A2 USE OF VANILLOID RECEPTOR-1 ANTAGONISTS FOR THE PREVENTION AND TREATMENT OF GLAUCOMA ALCON MANUFACTURING, LTD. (US) 2007-08-09 WO claimed
CN-1602191-A Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK AS (DK) 2005-03-30 CN claimed
WO-2023091628-A2 FORMULATIONS AND METHODS FOR TREATING SYMPTOMS OF MENOPAUSE PG13 LAUNCHPAD ALPHA, INC. DBA KINDRA (US) 2023-05-25 WO disclosed
US-20200215085-A1 Method to Abate Acute Airway Hypersensitivity and Asthma Attacks AAZEINTX INC. (CA) 2020-07-09 US disclosed
WO-2019014748-A1 METHOD TO ABATE ACUTE AIRWAY HYPERSENSITIVITY AND ASTHMA ATTACKS UTI LIMITED PARTNERSHIP (CA) 2019-01-24 WO disclosed
EP-1714961-B1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2015-12-09 EP disclosed
US-8343971-B2 Pharmacologically-active vanilloid carbamates RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-01-01 US disclosed
US-20120310140-A1 DIRECTED DELIVERY OF AGENTS TO NEURAL ANATOMY SPINAL MODULATION, INC. (US) 2012-12-06 US disclosed
US-20100234454-A1 TREATMENT OF CNIDARIA INTOXICATION KATHOLIEKE UNIVERSITEIT LEUVEN K.U. LEUVEN R&D (BE) 2010-09-16 US disclosed
WO-2010015260-A2 ADMINISTRATION BY INFUSION FOR THE TREATMENT OF ISCHEMIC EFFECTS NEUROKEY A/S (DK) 2010-02-11 WO disclosed
US-20070173537-A1 Indazole compound and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2007-07-26 US disclosed
CN-1326519-C Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK AS (DK) 2007-07-18 CN disclosed
US-20060281718-A1 Treatment of VR1-antagonist-induced increase in body temperature with an antipyretic agent AMGEN INC. 2006-12-14 US disclosed
EP-1714961-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2006-10-25 EP disclosed
CN-1798735-A 1-aryl-4- (aryloxycarbonyl) -piperazine derivatives as inhibitors of hormone sensitive lipase NOVO NORDISK AS (DK) 2006-07-05 CN disclosed
EP-1651638-A1 PYRIDYL PIPERAZINYL UREAS JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-03 EP disclosed
CN-1602191-A Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK AS (DK) 2005-03-30 CN disclosed
US-20050049241-A1 Pyridyl piperazinyl ureas JANSSEN PHARMACEUTICA, N.V. (BE) 2005-03-03 US disclosed
WO-2005014580-A1 PYRIDYL PIPERAZINYL UREAS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-02-17 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 (4 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-20070173537-A1 Indazole compound and pharmaceutical use thereof CYP3A5, CYP3A43, TP53 HSD11B1 137/4885GAA 1839/4885RBP4 4739/4885
US-20050049241-A1 Pyridyl piperazinyl ureas VIPR1, UTS2R, GPR17 HSD11B1 4722/4885GAA 4400/4885RBP4 1657/4885
US-20100234454-A1 TREATMENT OF CNIDARIA INTOXICATION CNR1, CNR2, AVPR1A HSD11B1 2276/4885GAA 2627/4885RBP4 2895/4885
US-20060281718-A1 Treatment of VR1-antagonist-induced increase in body temperature with an antipyretic agent VRK1, VIPR1, AVPR1A HSD11B1 1691/4885GAA 3330/4885RBP4 1381/4885

“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.