SCHEMBL9099239

SCHEMBL9099239

CCCCOC(=O)c1ccc(C=O)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.68
TSHR P16473 4/20 0.68
LMNA P02545 3/20 0.68
CYP1A2 P05177 3/20 0.68
CYP2C19 P33261 2/20 0.68
CYP2D6 P10635 2/20 0.68
MAPK1 P28482 1/20 0.68
NR1H2 P55055 1/20 0.68
RNASEL Q05823 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
CYP3A4 P08684 2/20 0.66
CYP2C9 P11712 1/20 0.66
PDE4D Q08499 1/20 0.66
HPGD P15428 1/20 0.59
RECQL P46063 1/20 0.59
ALDH1A1 P00352 3/20 0.58
NPC1 O15118 1/20 0.58
MAPT P10636 1/20 0.58
RAB9A P51151 1/20 0.58
STS P08842 7/20 0.57

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
SCHEMBL9097123 0.95 ALDH1A1 (0.65) ESR1TSHRLMNACYP1A2CYP2C19
SCHEMBL9762364 0.94 ALDH1A1 (0.68) ESR1TSHRLMNACYP1A2CYP2C19
SCHEMBL7721712 0.94 ALDH1A1 (0.68) ESR1TSHRLMNACYP1A2CYP2C19
SCHEMBL3906362 0.94 ALDH1A1 (0.68) ESR1TSHRLMNACYP1A2CYP2C19
SCHEMBL3041650 0.94 ALDH1A1 (0.68) ESR1TSHRLMNACYP1A2CYP2C19
SCHEMBL8557821 0.91 ESR1 (0.56) ESR1TSHRLMNACYP1A2CYP2C19
SCHEMBL3675655 0.90 ALDH1A1 (0.66) ESR1TSHRLMNACYP1A2CYP2C19
SCHEMBL20464827 0.89 MAPT (0.58) ESR1TSHRLMNACYP1A2CYP2C19
SCHEMBL11864509 0.88 ESR1 (0.70) ESR1TSHRLMNACYP1A2CYP2C19
SCHEMBL11864516 0.88 ESR1 (0.70) ESR1TSHRLMNACYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113348188-B Phenolic hydroxyl group-containing resin, photosensitive composition, resist film, curable composition, and cured product DIC株式会社 2024-05-10 CN disclosed
CN-113227181-B Resist composition DIC株式会社 2023-07-18 CN disclosed
CN-116023607-A Phenolic hydroxyl group-containing resin DIC株式会社 2023-04-28 CN disclosed
CN-113348188-A Phenolic hydroxyl group-containing resin, photosensitive composition, resist film, curable composition, and cured product DIC株式会社 2021-09-03 CN disclosed
CN-113227181-A Resist composition DIC株式会社 2021-08-06 CN disclosed
CN-103254053-B Alpha-fluoro Chalcone Compounds and preparation thereof and purposes CHENGDU INSTITUTE OF BIOLOGY, CHINESE ACADEMY OF SCIENCES (CN) 2016-04-13 CN disclosed
US-20140322767-A1 DROPLET MICROREACTOR COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2014-10-30 US disclosed
WO-2011106632-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 WO disclosed
US-7465719-B2 Carbamic acid compounds comprising an ester or ketone linkage as HDAC inhibitors TOPOTARGET UK LIMITED (GB) 2008-12-16 US disclosed
WO-2008130584-A1 PYRIMIDINONE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION (US) 2008-10-30 WO disclosed
US-3974278-A 1,4-Dihydropyridine esters BAYER AKTIENGESELLSCHAFT (DT) 1976-08-10 US disclosed
US-3971796-A 1,4-Dihydropyridine esters BAYER AKTIENGESELLSCHAFT (DT) 1976-07-27 US disclosed
US-3966948-A Spasmolytic, vaso-dilating and anti-hypertensive compositions and methods BAYER AKTIENGESELLSCHAFT (DT) 1976-06-29 US disclosed
US-3959474-A 2,6-Diamino-1,4-dihydropyridine-3,5-dicarboxylic acid esters used as coronary vessel dilators and anti-hypertensive agents BAYER AKTIENGESELLSCHAFT (DT) 1976-05-25 US disclosed
US-3957998-A ADMINISTERING BAYER AKTIENGESELLSCHAFT (DT) 1976-05-18 US disclosed
US-3951993-A HYPOTENSIVE, CORONARY VESSEL DILATORS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-20 US disclosed
US-3950336-A HYPOTENSIVE AGENTS, CORONARY VESSEL DILATORS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-13 US disclosed
US-3946028-A HYPOTENSIVE AGENTS, CORONARY VESSEL DILATORS BAYER AKTIENGESELLSCHAFT (DT) 1976-03-23 US disclosed
US-3946027-A HYPOTENSIVE AGENTS, CORONARY VESSEL DILATORS BAYER AKTIENGESELLSCHAFT (DT) 1976-03-23 US disclosed
US-3943140-A HYPOTENSIVE, VASODILATION BAYER AKTIENGESELLSCHAFT (DT) 1976-03-09 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-20140322767-A1 DROPLET MICROREACTOR STUB1, DIS3, MTREX ESR1 2750/4885TSHR 3801/4885LMNA 443/4885

“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.