SCHEMBL44393

SCHEMBL44393

COc1ccc(CN)cc1OC

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.70
KDM4E B2RXH2 1/20 0.70
CA2 P00918 2/20 0.68
CYP19A1 P11511 1/20 0.60
ALDH1A1 P00352 3/20 0.57
PPARG P37231 1/20 0.57
PPARD Q03181 1/20 0.57
PPARA Q07869 1/20 0.57
AOC3 Q16853 1/20 0.56
POLB P06746 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
LDHA P00338 1/20 0.52
KMT2A Q03164 1/20 0.51
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50

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
SCHEMBL29535675 1.00 ATM (0.70) ATMKDM4ECA2CYP19A1ALDH1A1
SCHEMBL19409880 1.00 ATM (0.70) ATMKDM4ECA2CYP19A1ALDH1A1
Hydrochloric Acid SCHEMBL9726669 0.98 ATM (0.68) ATMKDM4ECA2CYP19A1ALDH1A1
SCHEMBL8349185 0.87 KDM4E (0.56) ATMKDM4ECA2CYP19A1ALDH1A1
SCHEMBL9550638 0.87 CA2 (0.58) ATMKDM4ECA2CYP19A1ALDH1A1
SCHEMBL2894087 0.86 KDM4E (0.55) ATMKDM4ECA2CYP19A1ALDH1A1
SCHEMBL5708146 0.86 CALM1 (0.61) ATMKDM4ECA2CYP19A1TSHR
SCHEMBL27925716 0.86 KDM4E (0.54) ATMKDM4ECA2CYP19A1ALDH1A1
SCHEMBL1734396 0.85 KDM4E (0.53) ATMKDM4ECA2CYP19A1ALDH1A1
Hydrochloric Acid SCHEMBL5708154 0.85 KDM4E (0.64) ATMKDM4ECA2CYP19A1TSHR

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

Appears in 2405 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4557952-A1 TRIGEMINAL CUE FOR WILDLIFE REPELLENTS The United States of America, as represented by the Secretary of Agriculture (US) 2025-05-28 EP claimed
US-12187693-B2 Rapid synthesis method for biomass-based amine NANJING AGRICULTURAL UNIVERSITY (CN) 2025-01-07 US claimed
CN-118299130-A Steel-cored aluminum strand and preparation method thereof 河北正人电气有限公司 2024-07-05 CN claimed
CN-117843579-A Benzo heterocycle coupled catechol derivative and preparation method and application thereof 暨南大学 2024-04-09 CN claimed
CN-115650827-B Preparation method, intermediate compound and synthesis method for anthracycline derivatives 戊言医药科技(上海)有限公司 2024-03-15 CN claimed
US-20240023546-A1 TRIGEMINAL CUE FOR WILDLIFE REPELLENTS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2024-01-25 US claimed
WO-2024020079-A1 TRIGEMINAL CUE FOR WILDLIFE REPELLENTS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2024-01-25 WO claimed
CN-116217479-A Cannabidiol derivative and preparation method and application thereof 上海中医药大学 2023-06-06 CN claimed
CN-115650827-A Preparation method, intermediate compound and synthesis method for anthracycline derivatives 戊言医药科技(上海)有限公司 2023-01-31 CN claimed
CN-115651043-A Preparation method of anthracycline derivative 戊言医药科技(上海)有限公司 2023-01-31 CN claimed
EP-0635508-A1 TETRAHYDROPYRIDINE DERIVATIVE HAVING SUBSTITUENTS ON THREE RINGS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1995-01-25 EP claimed
EP-0328399-B1 PROCESS FOR THE PREPARATION OF 4-DEMETHOXYDAUNOMYCINONE, THE AGLYCONE OF 4-DEMETHOXY-DAUNORUBICIN FARMITALIA CARLO ERBA S.r.l. (IT) 1993-08-04 EP claimed
US-5015745-A Ketalization, sulfonylation, amination and diazotization to form a demethoxydaunomycinone FARMITALIA CARLO ERBA S.R.L. (IT) 1991-05-14 US claimed
US-4970297-A CONTAINING ISOXAZOLE RING SYNTEX (U.S.A.) INC. (US) 1990-11-13 US claimed
EP-0328399-A2 Process for the preparation of 4-demethoxydaunomycinone, the aglycone of 4-demethoxy-daunorubicin FARMITALIA CARLO ERBA S.r.l. (IT) 1989-08-16 EP claimed
EP-0156976-B1 OPTICALLY UNIFORM IMINES F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1987-09-30 EP claimed
EP-0156976-A2 Optically uniform imines F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1985-10-09 EP claimed
EP-0030009-B1 NEW DERIVATIVES OF THE 9-CIS-6,6'-DIAPO-PSI,PSI-CAROTENEDIOIC ACID, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Simes S.p.A. (IT) 1983-05-11 EP claimed
EP-0030009-A1 New derivatives of the 9-cis-6,6'-diapo-psi,psi-carotenedioic acid, preparation thereof and pharmaceutical compositions containing same Simes S.p.A. (IT) 1981-06-10 EP claimed
US-4076537-A Light-sensitive materials containing organo tellurium or selenium compounds and sensitizers FUJI PHOTO FILM CO., LTD. (JA) 1978-02-28 US claimed