SCHEMBL80721

SCHEMBL80721

NC(=O)c1ccccc1F

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.65
CES1 P23141 3/20 0.65
ALDH1A1 P00352 4/20 0.60
ALOX15 P16050 1/20 0.60
MAPT P10636 3/20 0.56
HPGD P15428 2/20 0.56
KDM4E B2RXH2 2/20 0.56
TSHR P16473 1/20 0.56
HSD17B10 Q99714 1/20 0.56
GAA P10253 2/20 0.54
METAP2 P50579 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
DGAT1 O75907 1/20 0.52
NPC1 O15118 2/20 0.50
HTT P42858 1/20 0.50
BCAT2 O15382 1/20 0.50
RAB9A P51151 1/20 0.49
PTPN1 P18031 1/20 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
SCHEMBL29482931 1.00 CES2 (0.65) CES2CES1ALDH1A1ALOX15MAPT
Hydrochloric Acid SCHEMBL28526382 0.98 CES2 (0.62) CES2CES1ALDH1A1ALOX15MAPT
Bromide SCHEMBL31218183 0.98 CES2 (0.62) CES2CES1ALDH1A1ALOX15MAPT
Water SCHEMBL27623262 0.98 CES2 (0.62) CES2CES1ALDH1A1ALOX15MAPT
SCHEMBL31376157 0.98 CES2 (0.62) CES2CES1ALDH1A1ALOX15MAPT
SCHEMBL31376156 0.98 CES2 (0.62) CES2CES1ALDH1A1ALOX15MAPT
SCHEMBL2392049 0.98 CES2 (0.62) CES2CES1ALDH1A1ALOX15MAPT
SCHEMBL4880434 0.98 CES2 (0.62) CES2CES1ALDH1A1ALOX15MAPT
Hydrochloric Acid SCHEMBL4376678 0.98 CES2 (0.62) CES2CES1ALDH1A1ALOX15MAPT
Hydrochloric Acid SCHEMBL2112522 0.98 CES2 (0.62) CES2CES1ALDH1A1ALOX15MAPT

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

Appears in 2564 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3802500-B1 MELANOCORTIN SUBTYPE-2 RECEPTOR (MC2R) ANTAGONISTS AND USES THEREOF CRINETICS PHARMACEUTICALS INC (US) 2026-05-27 EP claimed
US-20260069605-A1 KRAS INHIBITORS INCYTE CORP (US) 2026-03-12 US claimed
EP-4103559-B1 HETEROCYCLIC PAD4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2026-03-04 EP claimed
US-12545682-B2 Heterocyclic derivatives as P2X7 receptor antagonists BREYE THERAPEUTICS APS (DK) 2026-02-10 US claimed
EP-3623372-B1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH INC (US) 2026-02-04 EP claimed
US-12410174-B1 Small molecular inhibitors of sting signaling compositions and methods of use TYERELL IMMUNOTHERAPEUTICS INC (US) 2025-09-09 US claimed
CN-120202200-A Oxo-isoindolinyl substituted tetrahydropyrimidinedione-based compounds and applications thereof 标新生物医药科技(上海)有限公司 2025-06-24 CN claimed
EP-3883929-B1 4,5,6,7-TETRAHYDRO-L-BENZOTHIOPHENE MODULATORS OF RETINOIC ACID RECEPTOR RELATED (RAR) ORPHAN NUCLEAR RECEPTORS (RORS) 11949098 CANADA INC (CA) 2025-06-04 EP claimed
CN-116616298-B Sterilization composition containing fluorophenylether amide and benziothiazolinone and application thereof 陕西西大华特科技实业有限公司 2025-04-29 CN claimed
CN-119842078-A Polysulfone resin, preparation method thereof and polymer product 深圳市沃特新材料股份有限公司 2025-04-18 CN claimed
WO-2000027394-A1 ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE UNIVERSITY COLLEGE LONDON (GB) 2000-05-18 WO claimed
WO-2000025768-A1 OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES, INC. (US) 2000-05-11 WO claimed
EP-0973767-A1 INDAZOLES OF CYCLIC UREAS USEFUL AS HIV PROTEASE INHIBITORS Dupont Pharmaceuticals Company (US) 2000-01-26 EP claimed
US-5985867-A TREATING HIV INFECTION DUPONT PHARMACEUTICALS COMPANY (US) 1999-11-16 US claimed
WO-1999051580-A1 PYRAZOLE INHIBITORS OF CYTOKINE PRODUCTION ABBOTT LABORATORIES (US) 1999-10-14 WO claimed
WO-1999018104-A1 NAPHTHO-IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN TREATING CENTRAL NERVOUS SYSTEM DISORDERS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 1999-04-15 WO claimed
WO-1998043969-A1 INDAZOLES OF CYCLIC UREAS USEFUL AS HIV PROTEASE INHIBITORS DUPONT PHARMACEUTICALS COMPANY (US) 1998-10-08 WO claimed
WO-1993014062-A1 ANTHELMINTIC β-KETOAMIDES THE UPJOHN COMPANY (US) 1993-07-22 WO claimed
US-3943152-A Method for preparing azines PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1976-03-09 US claimed
US-3943132-A Process for the preparation of hydrazones PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1976-03-09 US claimed