SCHEMBL2201549

SCHEMBL2201549

[CH2]C(O)(O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 4/20 0.43
TSHR P16473 3/20 0.43
KCNN4 O15554 3/20 0.43
ALOX15 P16050 1/20 0.40
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.39
ESR1 P03372 2/20 0.39
ESR2 Q92731 2/20 0.39
CYP3A4 P08684 2/20 0.39
PTPN1 P18031 1/20 0.39
MAPK1 P28482 2/20 0.38
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL1384161 0.81 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19ALDH1A1TSHR
SCHEMBL1253796 0.77 ALDH1A1 (0.48) CYP1A2CYP2C9CYP2C19ALDH1A1TSHR
SCHEMBL6014072 0.77 TSHR (0.52) CYP1A2CYP2C9CYP2C19ALDH1A1TSHR
SCHEMBL5184997 0.77 KCNN4 (0.52) CYP1A2CYP2C9CYP2C19ALDH1A1TSHR
SCHEMBL4887210 0.75 KDM4E (0.48) CYP1A2CYP2C9CYP2C19ALDH1A1TSHR
SCHEMBL902761 0.75 ALDH1A1 (0.42) CYP1A2CYP2C9CYP2C19ALDH1A1TSHR
SCHEMBL10608360 0.75 ALDH1A1 (0.42) CYP1A2CYP2C9CYP2C19ALDH1A1TSHR
SCHEMBL7173455 0.73 CYP1A2 (0.48) CYP1A2CYP2C9CYP2C19ALDH1A1TSHR
SCHEMBL3173030 0.73 KCNN4 (0.47) CYP1A2CYP2C9CYP2C19ALDH1A1TSHR
Triphenylmethanol SCHEMBL456603 0.73 CYP19A1 (0.50) CYP1A2CYP2C9CYP2C19ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108117779-A Environment-friendly coating capable of generating negative oxygen ions and preparation method thereof 金华联创塑粉科技有限公司 2018-06-05 CN claimed
CN-118325004-A Phenolic hydroxyl group-containing resin, photosensitive resin composition, curable composition, and resist film DIC株式会社 2024-07-12 CN disclosed
CN-118011733-A Positive photosensitive resin composition, resist film, resist underlayer film, and resist permanent film DIC株式会社 2024-05-10 CN disclosed
CN-117487097-A Surface-modified carbon black, carbon black dispersion, and black resist composition DIC株式会社 2024-02-02 CN disclosed
CN-117321109-A Phenolic hydroxyl group-containing resin DIC株式会社 2023-12-29 CN disclosed
WO-2023224055-A1 PHARMACEUTICAL COMPOSITION FOR USE IN THERAPEUTIC OR PROPHYLACTIC METHOD FOR KIDNEY INJURY, COMBINED MEDICINE CONTAINING SAID PHARMACEUTICAL COMPOSITION, AND CCBL1 INHIBITOR 学校法人藤田学園 2023-11-23 WO disclosed
CN-116023607-A Phenolic hydroxyl group-containing resin DIC株式会社 2023-04-28 CN disclosed
CN-115873214-A Epoxy resin, photosensitive resin composition, resist film, curable composition, and cured film DIC株式会社 2023-03-31 CN disclosed
US-11129781-B2 Agent for hair deforming treatment KAO CORPORATION (JP) 2021-09-28 US disclosed
CN-107652222-B Oxime ester photoinitiators 巴斯夫欧洲公司 2021-09-10 CN disclosed
EP-2346044-A1 UV-CURABLE RESIN COMPOSITIONS FOR OPTICAL DISCS AND CURED PRODUCTS THEREOF Nippon Kayaku Kabushiki Kaisha (JP) 2011-07-20 EP disclosed
EP-1881835-A1 TRIAZINE COMPOUNDS AND COMPOSITIONS THEREOF FOR THE TREATMENT OF CANCERS ProMetic BioSciences Inc. (CA) 2008-01-30 EP disclosed
CN-1882680-A Cleaning composition RECKITT BENCKISER INC (US) 2006-12-20 CN disclosed
CN-1882679-A Cleaning composition RECKITT BENCKISER INC (US) 2006-12-20 CN disclosed
WO-2006122431-A1 TRIAZINE COMPOUNDS AND COMPOSITIONS THEREOF FOR THE TREATMENT OF CANCERS PROMETIC BIOSCIENCES INC. (CA) 2006-11-23 WO disclosed
US-6294521-B1 SUGAR PHOSPHATES AUSTRALIAN NATIONAL UNIVERSITY (AU) 2001-09-25 US disclosed
EP-0057777-B1 DIBENZOXAZONINE, DIBENZOXAZECINE, DIBENZOXAAZACYCLOUNDECANE DERIVATIVES AND THEIR CORRESPONDING THIA- AND AZA DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS AKZO N.V. (NL) 1984-10-10 EP disclosed
US-4374133-A PSYCHOLOGICAL DISORDERS AKZO N.V. (NL) 1983-02-15 US disclosed
EP-0057777-A1 Dibenzoxazonine, dibenzoxazecine, dibenzoxaazacycloundecane derivatives and their corresponding thia- and aza derivatives, their preparation and pharmaceutical compositions AKZO N.V. (NL) 1982-08-18 EP disclosed
WO-1982002199-A1 TRICYCLIC COMPOUNDS AKZO NV (NL) 1982-07-08 WO 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-11129781-B2 Agent for hair deforming treatment GRHPR, SLC26A4, COL1A1 CYP1A2 2314/4885CYP2C9 3671/4885CYP2C19 3223/4885

“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.