SCHEMBL412049

SCHEMBL412049

[CH2]c1cccc2c1ccc1ccccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 4/20 0.67
ALDH1A1 P00352 6/20 0.57
HSD17B10 Q99714 4/20 0.57
CYP2A6 P11509 3/20 0.57
TDP1 Q9NUW8 2/20 0.57
TSHR P16473 2/20 0.57
PAX8 Q06710 1/20 0.48
CYP1A2 P05177 5/20 0.48
HPGD P15428 3/20 0.48
HIF1A Q16665 2/20 0.48
CYP1B1 Q16678 1/20 0.48
THRB P10828 1/20 0.48
LMNA P02545 2/20 0.44
MAPK1 P28482 2/20 0.44
CYP3A4 P08684 2/20 0.44
MAPT P10636 1/20 0.44
APEX1 P27695 1/20 0.44
PMP22 Q01453 1/20 0.44
ERBB2 P04626 1/20 0.43
FYN P06241 1/20 0.43

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
SCHEMBL28043851 1.00 HPRT1 (0.67) HPRT1ALDH1A1HSD17B10CYP2A6TDP1
SCHEMBL3074 0.85 ALDH1A1 (0.53) HPRT1ALDH1A1HSD17B10CYP2A6TDP1
Hydrochloric Acid SCHEMBL28510169 0.82 ALDH1A1 (0.50) HPRT1ALDH1A1HSD17B10CYP2A6TDP1
SCHEMBL27887348 0.82 ALDH1A1 (0.50) HPRT1ALDH1A1HSD17B10CYP2A6TDP1
SCHEMBL29026281 0.82 ALDH1A1 (0.50) HPRT1ALDH1A1HSD17B10CYP2A6TDP1
Ethylene SCHEMBL28814532 0.82 HPRT1 (0.88) HPRT1ALDH1A1HSD17B10CYP2A6TDP1
Chrysene SCHEMBL27115 0.82 HPRT1 (1.00) HPRT1ALDH1A1HSD17B10CYP2A6TDP1
Chrysene SCHEMBL9786466 0.82 HPRT1 (1.00) HPRT1ALDH1A1HSD17B10CYP2A6TDP1
SCHEMBL25510 0.82 HPRT1 (1.00) HPRT1ALDH1A1HSD17B10CYP2A6TDP1
SCHEMBL29451340 0.82 HPRT1 (1.00) HPRT1ALDH1A1HSD17B10CYP2A6TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114957140-A Axial chiral 1,2, 3-triazole compound and preparation method and application thereof 温州大学 2022-08-30 CN claimed
EP-1891106-A2 NOVEL COMPOUNDS AS GLP-I AGONISTS CADILA HEALTHCARE LTD. (IN) 2008-02-27 EP claimed
WO-2007017892-A2 NOVEL COMPOUNDS AS GLP-I AGONISTS CADILA HEALTHCARE LIMITED (IN) 2007-02-15 WO claimed
EP-1737925-A1 NEW ORGANIC LUMINESCENT ELEMENT Ciba Specialty Chemicals Holding Inc. (CH) 2007-01-03 EP claimed
WO-2005100505-A1 NEW ORGANIC LUMINESCENT ELEMENT CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-10-27 WO claimed
EP-1095043-A1 TRIOXANE DERIVATIVES The Hong Kong University of Science & Technology (HK) 2001-05-02 EP claimed
WO-2000004026-A1 TRIOXANE DERIVATIVES THE HONG KONG UNIVERSITY OF SCIENCE & TECHNOLOGY (CN) 2000-01-27 WO claimed
EP-0974354-A1 Artemisinin derivatives The Hong Kong University of Science & Technology (HK) 2000-01-26 EP claimed
US-20240239745-A1 METHOD FOR SYNTHESIZING BILIRUBIN Bilix Co., Ltd. (KR) 2024-07-18 US disclosed
EP-4234609-B1 METHODS FOR PURIFICATION, DETECTION AND QUANTIFICATION OF RESIDUAL PEI-BASED TRANSFECTION REAGENTS POLYPLUS TRANSFECTION (FR) 2024-07-17 EP disclosed
EP-4375280-A1 METHOD FOR SYNTHESIZING BILIRUBIN Bilix Co., Ltd. (KR) 2024-05-29 EP disclosed
EP-4371984-A1 METHOD FOR SYNTHESIZING BILIRUBIN Bilix Co., Ltd. (KR) 2024-05-22 EP disclosed
EP-4371985-A1 METHOD FOR SYNTHESIZING BILIRUBIN Bilix Co., Ltd. (KR) 2024-05-22 EP disclosed
EP-4019607-B1 ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INT (FR) 2024-05-15 EP disclosed
EP-0501656-A2 New benzene derivatives having (NGF) production-promoting activity Sankyo Company Limited (JP) 1992-09-02 EP disclosed
US-4940709-A PLATELET ACTIVATING FACTOR FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-07-10 US disclosed
US-4806538-A ANTICOAGULANT, HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-02-21 US disclosed
EP-0181152-A1 Piperazine compound as PAF-antagonist FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-05-14 EP disclosed
US-4254214-A BLACK, REDUCTION OF COPPER SALT OR COMPLEX TO COPPER FUJI PHOTO FILM CO., LTD. (JP) 1981-03-03 US disclosed
US-4241079-A ANTHELMINTICS AND FUNGICIDES ROHM AND HAAS COMPANY (US) 1980-12-23 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-20240239745-A1 METHOD FOR SYNTHESIZING BILIRUBIN CYP7A1, UGT1A3, UGT1A1 HPRT1 441/4885ALDH1A1 225/4885HSD17B10 339/4885

“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.