SCHEMBL651789

SCHEMBL651789

Cc1c([N+](=O)[O-])cc2c(c1[N+](=O)[O-])C(C)(C)CC2(C)C

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HNF4A P41235 2/20 0.44
TSHR P16473 8/20 0.43
TDP1 Q9NUW8 4/20 0.43
ALDH1A1 P00352 4/20 0.43
CYP1A2 P05177 1/20 0.37
GPR35 Q9HC97 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CCR6 P51684 1/20 0.34
CYP3A4 P08684 1/20 0.33
ACHE P22303 1/20 0.32

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
SCHEMBL29977890 0.83 MAPT (0.49) MAPTMAPK1NPSR1HNF4ATSHR
SCHEMBL15415386 0.78 TSHR (0.43) MAPTMAPK1NPSR1HNF4ATSHR
SCHEMBL15415677 0.77 TSHR (0.42) MAPTNPSR1TSHRTDP1ALDH1A1
SCHEMBL15416260 0.76 ALDH1A1 (0.46) MAPTMAPK1NPSR1TSHRTDP1
SCHEMBL15428169 0.74 TSHR (0.43) MAPTMAPK1NPSR1TSHRTDP1
SCHEMBL11503264 0.73 MAPT (0.41) MAPTMAPK1NPSR1HNF4ATSHR
SCHEMBL2519558 0.71 TSHR (0.55) MAPTTSHRTDP1ALDH1A1CYP1A2
SCHEMBL11216738 0.70 TDP1 (0.37) MAPTTSHRTDP1ALDH1A1CYP1A2
SCHEMBL11209520 0.70 HNF4A (0.43) MAPTMAPK1NPSR1HNF4ATSHR
SCHEMBL19509344 0.69 HNF4A (0.53) MAPTMAPK1NPSR1HNF4ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130102981-A1 Control of Female Body Odours QUEST INTERNATIONAL SERVICES B.V. (NL) 2013-04-25 US claimed
WO-2011084492-A1 TRASH BAG WITH MALODOR CONTROL THE GLAD PRODUCTS COMPANY (US) 2011-07-14 WO claimed
US-20110164834-A1 TRASH BAG WITH MALODOR CONTROL THE GLAD PRODUCTS COMPANY (US) 2011-07-07 US claimed
EP-1979416-A2 SILICONE ADDITIVES FOR COMPATABILIZING ORGANIC COMPOUNDS WITH WAX MIXTURES Momentive Performance Materials Inc. (US) 2008-10-15 EP claimed
US-20080028670-A1 SILICONE ADDITIVES FOR COMPATALIZING ORGANIC COMPOUNDS WITH WAX MIXTURES GENERAL ELECTRIC COMPANY (US) 2008-02-07 US claimed
US-20070166341-A1 Solid volatile composition and method and system for making the same INTERNATIONAL ARTS & SCIENCE GROUP, INC. 2007-07-19 US claimed
WO-2007075537-A2 SILICONE ADDITIVES FOR COMPATABILIZING ORGANIC COMPOUNDS WITH WAX MIXTURES MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2007-07-05 WO claimed
US-20070105747-A1 Control of body odours QUEST INTERNATIONAL SERVICES B.V. (NL) 2007-05-10 US claimed
US-20070105748-A1 Control of female body odours QUEST INTERNATIONAL SERVICES B.V. (NL) 2007-05-10 US claimed
EP-1631329-B1 CONTROL OF FEMALE BODY ODOURS QUEST INT SERV BV (NL) 2007-01-24 EP claimed
US-5501805-A CONTAINING MUSK, SALICYLATE, ADDITIONAL FRAGRANCES; HAVING LOW ODOR INTENSITY LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1996-03-26 US claimed
US-4162221-A Synthetic musk-based composition, its production and applications SOCIETE DES PRODUITS CHIMIQUES ET MATIERES COLORANTES DE MULHOUSE (FR) 1979-07-24 US claimed
US-20260033492-A1 Pest Repellents and Uses Thereof SENSORYGEN INC (US) 2026-02-05 US disclosed
EP-4664463-A1 COMPUTER-IMPLEMENTED METHOD FOR OLFACTORY PROPERTY PREDICTION Givaudan SA (CH) 2025-12-17 EP disclosed
US-12461089-B2 Olfactory receptor involved in the perception of musk fragrance and the use thereof CHEMOSENSORYX BIOSCIENCES SA (BE) 2025-11-04 US disclosed
EP-4634213-A1 MODIFIED OLFACTORY RECEPTORS Givaudan SA (CH) 2025-10-22 EP disclosed
WO-1991008466-A1 SELECTIVE DETECTION OF VAPORS THERMEDICS INC. (US) 1991-06-13 WO disclosed
US-4956341-A PERFUMES BASF AKTIENGESELLSCHAFT (DE) 1990-09-11 US disclosed
US-4923631-A MONOPERSULFATE SALTS AND-OR ORGANIC PEROXYACIDS LEVER BROTHERS COMPANY (US) 1990-05-08 US disclosed
US-4162221-A Synthetic musk-based composition, its production and applications SOCIETE DES PRODUITS CHIMIQUES ET MATIERES COLORANTES DE MULHOUSE (FR) 1979-07-24 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-20260033492-A1 Pest Repellents and Uses Thereof F3, TFPI, FLI1 MAPT 122/4885MAPK1 3258/4885NPSR1 2733/4885

“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.