SCHEMBL367454

SCHEMBL367454

CC=C(Cc1ccccc1)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.66
CYP2C9 P11712 1/20 0.66
CES1 P23141 2/20 0.54
CES2 O00748 1/20 0.54
AKR1B1 P15121 1/20 0.54
CTBP2 P56545 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
TSHR P16473 2/20 0.46
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45
ALDH1A1 P00352 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 1/20 0.44
EPHX2 P34913 1/20 0.44
GAA P10253 2/20 0.43
HPGD P15428 1/20 0.43
PAM P19021 2/20 0.42

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
SCHEMBL265774 1.00 CYP3A4 (0.66) CYP3A4CYP2C9CES1CES2AKR1B1
SCHEMBL7923429 1.00 CYP3A4 (0.66) CYP3A4CYP2C9CES1CES2AKR1B1
SCHEMBL10073601 0.83 CTBP2 (0.55) CYP3A4CYP2C9CTBP2MEN1KMT2A
SCHEMBL27840697 0.83 CYP3A4 (0.52) CYP3A4CYP2C9CES1CES2AKR1B1
SCHEMBL4740992 0.83 CYP3A4 (0.52) CYP3A4CYP2C9CES1CES2AKR1B1
SCHEMBL4740994 0.83 CYP3A4 (0.52) CYP3A4CYP2C9CES1CES2AKR1B1
SCHEMBL21081470 0.83 CYP3A4 (0.52) CYP3A4CYP2C9CES1CES2AKR1B1
SCHEMBL8921169 0.83 CYP3A4 (0.66) CYP3A4CYP2C9CES1CES2AKR1B1
SCHEMBL11401347 0.83 CYP3A4 (0.66) CYP3A4CYP2C9CES1CES2AKR1B1
SCHEMBL7336694 0.82 CYP3A4 (0.59) CYP3A4CYP2C9CES1CES2AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116693384-A Preparation method of beta, gamma-unsaturated carboxylic acid benzyl ester compound 大连理工大学 2023-09-05 CN disclosed
EP-2574976-B1 Ophthalmic devices having a highly selective violet light transmissive filter JOHNSON & JOHNSON SURGICAL VISION INC (US) 2021-08-11 EP disclosed
US-10481314-B2 Display apparatus and polarizer thereof LG DISPLAY CO., LTD. (KR) 2019-11-19 US disclosed
US-20170023718-A1 DISPLAY APPARATUS AND POLARIZER THEREOF LG DISPLAY CO., LTD. (KR) 2017-01-26 US disclosed
US-9550732-B2 Salt of pyrrolidin-3-yl acetic acid derivative and crystals thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2017-01-24 US disclosed
EP-2975035-A1 SALT OF PYRROLIDIN-3-YL ACETIC ACID DERIVATIVE AND CRYSTALS THEREOF Eisai R&D Management Co., Ltd. (JP) 2016-01-20 EP disclosed
US-20160002165-A1 SALT OF PYRROLIDIN-3-YL ACETIC ACID DERIVATIVE AND CRYSTALS THEREOF EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-01-07 US disclosed
EP-2574976-A1 Ophthalmic devices having a highly selective violet light transmissive filter and related methods Abbott Medical Optics Inc. (US) 2013-04-03 EP disclosed
US-8388681-B2 Intraocular lenses having a visible light-selective-transmissive-region Abbott Medical Optics Inc. (US) 2013-03-05 US disclosed
EP-1699385-B1 INTRAOCULAR LENSES HAVING A VISIBLE LIGHT-SELECTIVE-TRANSMISSIVE-REGION ABBOTT MEDICAL OPTICS INC (US) 2012-10-24 EP disclosed
EP-0784652-A1 INTRAOCULAR LENS MATERIALS Pharmacia & Upjohn Aktiebolag (SE) 1997-07-23 EP disclosed
WO-1996011235-A1 INTRAOCULAR LENS MATERIALS PHARMACIA & UPJOHN AB (SE) 1996-04-18 WO disclosed
US-5143908-A Carboxylic acids containing amino and phosphinyl groups MERCK & CO., INC. (US) 1992-09-01 US disclosed
US-5099063-A 3-(1-aminoalkylphosphinyl)-(2-substituted)propionic acids MERCK & CO., INC. (US) 1992-03-24 US disclosed
US-5039664-A Hypotensive agent MERCK & CO., INC. (US) 1991-08-13 US disclosed
US-5037807-A Hypotensive agents; for treatment of congestive heart failure MERCK & CO., INC. (US) 1991-08-06 US disclosed
US-4839357-A TREATMENT OF HYPERTENSION, CONGESTIVE HEART FAILURE MERCK & CO., INC. (US) 1989-06-13 US disclosed
EP-0278158-A2 Renin inhibitors containing phenylalanyl-histidine replacements MERCK & CO. INC. (US) 1988-08-17 EP disclosed
EP-0266978-A2 Novel antibacterial agents and potentiators of carbapenem antibiotics MERCK & CO. INC. (US) 1988-05-11 EP disclosed
US-4715994-A PHOSPHINIC ACID DERIVATIVES MERCK & CO., INC. (US) 1987-12-29 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-20160002165-A1 SALT OF PYRROLIDIN-3-YL ACETIC ACID DERIVATIVE AND CRYSTALS THEREOF ACP3, PKD1, ACMSD CYP3A4 3138/4885CYP2C9 2968/4885CES1 4074/4885

“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.