Acetic Acid

Acetic Acid

SCHEMBL22497420

CC(=O)O.O=C(C(CC1CCCCC1)=NO)c1ccc(Sc2ccccc2)cc1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.44
ALDH1A1 P00352 1/20 0.44
EPHX2 P34913 2/20 0.39
NPC1 O15118 4/20 0.38
RAB9A P51151 3/20 0.38
CHEK2 O96017 1/20 0.36
LMNA P02545 2/20 0.36
EZH2 Q15910 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
P2RX7 Q99572 1/20 0.35
CHRNA7 P36544 1/20 0.35
POLB P06746 1/20 0.35
MGLL Q99685 1/20 0.35
KMT2A Q03164 1/20 0.34

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
SCHEMBL29503070 0.96 EPHX2 (0.42) HPGDALDH1A1EPHX2NPC1RAB9A
SCHEMBL24634212 0.96 EPHX2 (0.42) HPGDALDH1A1EPHX2NPC1RAB9A
SCHEMBL860742 0.95 HPGD (0.42) HPGDALDH1A1EPHX2NPC1RAB9A
Benzoic Acid SCHEMBL29503073 0.91 CES2 (0.40) HPGDALDH1A1EPHX2NPC1RAB9A
SCHEMBL18799991 0.90 HTT (0.39) HPGDALDH1A1EPHX2NPC1RAB9A
SCHEMBL18351278 0.90 HTT (0.39) HPGDALDH1A1EPHX2NPC1RAB9A
SCHEMBL16371669 0.85 ALDH1A1 (0.42) HPGDALDH1A1EPHX2NPC1RAB9A
SCHEMBL28883558 0.85 ALDH1A1 (0.42) HPGDALDH1A1EPHX2NPC1RAB9A
SCHEMBL17069996 0.85 ALDH1A1 (0.42) HPGDALDH1A1EPHX2NPC1RAB9A
SCHEMBL16371670 0.85 ALDH1A1 (0.42) HPGDALDH1A1EPHX2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111752096-B Photosensitive resin composition for color filter and color filter 常州正洁智造科技有限公司 2022-10-14 CN disclosed
CN-115128899-A Photosensitive resin composition with improved system hue stability 常州正洁智造科技有限公司 2022-09-30 CN disclosed
CN-111752091-B Application of HABI mixed photoinitiator in UVLED photocuring 常州正洁智造科技有限公司 2022-09-06 CN disclosed
CN-112835261-B EO/PO modified 9-phenylacridine photosensitizer and application thereof 常州强力电子新材料股份有限公司 2022-06-07 CN disclosed
CN-114442425-A Curable resin composition, solder resist film formed from the same, interlayer insulating material, and printed wiring board 常州正洁智造科技有限公司 2022-05-06 CN disclosed
CN-114326299-A Photosensitive resin composition, optical filter and application 常州强力电子新材料股份有限公司 2022-04-12 CN disclosed
CN-114326309-A Photosensitive resin composition and application thereof 常州正洁智造科技有限公司 2022-04-12 CN disclosed
WO-2021104224-A1 EO/PO-MODIFIED 9-PHENYLACRIDINE PHOTOSENSITIZER AND APPLICATION THEREOF 常州强力电子新材料股份有限公司 2021-06-03 WO disclosed
WO-2020233700-A1 HABI PHOTOINITIATOR CAPABLE OF IMPROVING SYSTEM STABILITY AND APPLICATION THEREOF 常州格林感光新材料有限公司 (CN) 2020-11-26 WO disclosed
WO-2020200020-A1 HEXAARYLBIIMIDAZOLE PHOTOINITIATOR AND APPLICATION THEREOF 常州格林感光新材料有限公司 2020-10-08 WO disclosed