SCHEMBL398128

SCHEMBL398128

N#CCc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
LOXL2 Q9Y4K0 1/20 0.55
TSHR P16473 1/20 0.52
IDO1 P14902 2/20 0.50
ALDH1A1 P00352 3/20 0.48
CYP2C19 P33261 3/20 0.48
POLB P06746 1/20 0.48
KCNH2 Q12809 3/20 0.47
KCNJ1 P48048 2/20 0.47
HPGD P15428 1/20 0.47
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 1/20 0.46
ACHE P22303 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PYCR1 P32322 1/20 0.45
AKR1C3 P42330 1/20 0.44

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
SCHEMBL8596029 0.89 MAPT (0.54) GAAL3MBTL1LOXL2TSHRIDO1
SCHEMBL15545212 0.85 GAA (0.61) GAAL3MBTL1IDO1ALDH1A1KCNH2
SCHEMBL4223676 0.83 LOXL2 (0.59) LOXL2TSHRIDO1ALDH1A1CYP2C19
SCHEMBL523810 0.81 LOXL2 (0.57) LOXL2TSHRIDO1ALDH1A1CYP2C19
SCHEMBL4001120 0.80 TSHR (0.58) LOXL2TSHRIDO1ALDH1A1CYP2C19
SCHEMBL10566436 0.79 ALDH1A1 (0.57) GAAL3MBTL1LOXL2TSHRIDO1
SCHEMBL3633599 0.79 LOXL2 (0.55) LOXL2TSHRIDO1ALDH1A1CYP2C19
SCHEMBL12415783 0.79 L3MBTL1 (0.44) GAAL3MBTL1LOXL2TSHRALDH1A1
SCHEMBL4521415 0.79 PYCR1 (0.57) LOXL2TSHRIDO1ALDH1A1CYP2C19
SCHEMBL4230681 0.79 LOXL2 (0.55) LOXL2TSHRIDO1ALDH1A1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025090061-A1 ULTRASONIC INDICATOR DEVICE AND METHOD FOR MONITORING ULTRASONICATION JP LABORATORIES, INC. (US) 2025-05-01 WO claimed
WO-2025075611-A1 ULTRASONIC INDICATOR BASED ON EMULSION FORMATION JP LABORATORIES, INC. (US) 2025-04-10 WO claimed
CN-118185222-A SBS-based dynamic reversible cross-linked luminous liquid crystal elastomer and preparation method thereof 大连理工大学 2024-06-14 CN claimed
CN-117050030-A Pd detection method 2+ Fluorescent probe of (2), preparation method and application thereof 福建省金皇环保科技有限公司 2023-11-14 CN claimed
CN-116987006-A Novel method for preparing p-aminophenylacetonitrile by reducing sodium sulfide 安徽科芯微流化工科技有限公司 2023-11-03 CN claimed
CN-116693396-A Preparation method of p-nitrophenylacetic acid 枣阳星耀化工有限公司 2023-09-05 CN claimed
CN-112479930-B Alpha-phenyl cinnamonitrile derivative and preparation method and application thereof 洛阳师范学院 2023-04-28 CN claimed
CN-115197095-A Fluorescent gel factor and gel thereof 湖北文理学院 2022-10-18 CN claimed
CN-112094284-B Aggregation-induced emission dye and application thereof in phthalate detection 江苏大学 2022-07-22 CN claimed
CN-109970634-B Pyridine Schiff base structure fluorescent probe for detecting copper ions and preparation method and application thereof 福建师范大学 2022-03-15 CN claimed
US-5118814-A Pressure sensitive and heat sensitive recording media BAYER AKTIENGESELLSCHAFT (DE) 1992-06-02 US claimed
EP-0417555-A1 Pentamethine dyes and derivatives BAYER AG (DE) 1991-03-20 EP claimed
EP-0370198-A1 Tetraindolyl heptamethine derivatives BAYER AG (DE) 1990-05-30 EP claimed
EP-0190087-B1 FORGE-PROOF SECURITY PAPER, PROCESS FOR MAKING A PAPER FORGE-PROOF AND AQUEOUS OR ORGANIC COMPOSITION ESPECIALLY USEFUL IN MAKING A PAPER FORGE-PROOF AUSSEDAT-REY (FR) 1988-04-06 EP claimed
EP-0078709-B1 PREPARATION OF NITROARALKYL CYANIDES AND DERIVATIVES THEREOF ETHYL CORPORATION (US) 1986-10-01 EP claimed
EP-0190087-A1 Forge-proof security paper, process for making a paper forge-proof and aqueous or organic composition especially useful in making a paper forge-proof AUSSEDAT-REY (FR) 1986-08-06 EP claimed
US-4567004-A Process for the preparation of monomethyl-substituted methylene compounds BAYER AKTIENGESELLSCHAFT (DE) 1986-01-28 US claimed
US-4499026-A Nucleophilic substitution process ETHYL CORPORATION (US) 1985-02-12 US claimed
EP-0078709-A2 Preparation of nitroaralkyl cyanides and derivatives thereof ETHYL CORPORATION (US) 1983-05-11 EP claimed
US-4003747-A Photosensitive azide compound containing color-forming element HODOGAYA CHEMICAL CO., LTD. (JA) 1977-01-18 US claimed