SCHEMBL5598796

SCHEMBL5598796

C=CC(OC)c1ccccc1C(C=C)OC

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.33
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
KDM4E B2RXH2 4/20 0.31
MAPT P10636 4/20 0.31
HPGD P15428 4/20 0.31
CYP3A4 P08684 4/20 0.31
ALOX15 P16050 4/20 0.31
TP53 P04637 3/20 0.31
TDP1 Q9NUW8 3/20 0.31
ALDH1A1 P00352 3/20 0.31
USP2 O75604 2/20 0.31
HSD17B10 Q99714 2/20 0.31
LMNA P02545 2/20 0.31
ALOX12 P18054 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31

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
SCHEMBL28899530 0.94 ESR1 (0.34) ESR1
SCHEMBL2224883 0.86
SCHEMBL1021604 0.86 GABRA1 (0.47) KDM4EMAPTHPGDCYP3A4ALOX15
SCHEMBL194133 0.79 KDM4E (0.40) KDM4EMAPTHPGDCYP3A4ALOX15
SCHEMBL16308021 0.79 KDM4E (0.40) KDM4EMAPTHPGDCYP3A4ALOX15
SCHEMBL2028661 0.78 HPGD (0.43) SLC6A4KDM4EMAPTHPGDCYP3A4
SCHEMBL8752281 0.78 MYC (0.36) KDM4EMAPTHPGDCYP3A4ALOX15
SCHEMBL7091649 0.77
SCHEMBL7036350 0.76 GABRA1 (0.30) GABRA1GABRB2
SCHEMBL7776205 0.74 CA1 (0.46) CYP3A4TP53TDP1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4138411-A RUTHENIUM OR OSMIUM CATALYST RHONE-POULENC S. A. (FR) 1979-02-06 US claimed
US-12441669-B2 PCNHCP metal complexes and uses thereof TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2025-10-14 US disclosed
US-20230322647-A1 PCNHCP METAL COMPLEXES AND USES THEREOF TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2023-10-12 US disclosed
WO-2022229784-A1 MIXTURES OF EMULSIFIED TERPENES HAVING ANTIBACTERIAL AND ANTIFUNGAL ACTIVITY VILLAGOMEZ DIAZ, Jennifer Paulina (EC) 2022-11-03 WO disclosed
WO-2022043993-A1 PCNHCP METAL COMPLEXES AND USES THEREOF TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2022-03-03 WO disclosed
US-9572850-B2 Use of cajeput and Pimenta racemosa extract for treating parasitic infestation of fish MARS, INCORPORATED (US) 2017-02-21 US disclosed
EP-2461698-B1 USE OF CAJEPUT AND PIMENTA RACEMOSA EXTRACT FOR TREATING PARASITIC INFESTATION OF FISH MARS INC (US) 2013-02-13 EP disclosed
US-20120276227-A1 USE OF CAJEPUT AND PIMENTA RACEMOSA EXTRACT FOR TREATING PARASITIC INFESTATION OF FISH MARS, INCORPORATED (US) 2012-11-01 US disclosed
EP-2461698-A1 USE OF CAJEPUT AND PIMENTA RACEMOSA EXTRACT FOR TREATING PARASITIC INFESTATION OF FISH Mars, Incorporated (US) 2012-06-13 EP disclosed
EP-1363650-B1 COMPOSITION CONTAINING PIMENTA EXTRACT IN AQUATIC ANIMAL TREATMENT METHODS AQUARIUM PHARMA (US) 2007-09-26 EP disclosed
EP-1259493-A2 SUBSTITUTED PIPERAZINE COMPOUNDS CV THERAPEUTICS, INC. (US) 2002-11-27 EP disclosed
US-20020164384-A1 Aquatic animal treatment method and composition containing pimenta extract AQUARIUM PHARMACEUTICALS, INC. (US) 2002-11-07 US disclosed
WO-2002069989-A2 AQUATIC ANIMAL TREATMENT METHOD AND COMPOSITION CONTAINING PIMENTA EXTRACT AQUARIUM PHARMACEUTICALS, INC. (US) 2002-09-12 WO disclosed
US-20010041704-A1 N-(2,6-dimethylphenyl)-2-(4-(2-hydroxy-4-phenylbutyl) -piperazinyl)acetamide, for example; useful to protect skeletal muscles against damage from trauma or disease, treat shock, preserve donor tissue or organs; greater half-life CV THERAPEUTICS, INC. 2001-11-15 US disclosed
US-20010036961-A1 Substituted alkylene diamine compounds CV THERAPEUTICS, INC. 2001-11-01 US disclosed
WO-2001062711-A2 SUBSTITUTED ALKYLENE DIAMINE COMPOUNDS CV THERAPEUTICS, INC. (US) 2001-08-30 WO disclosed
WO-2001062744-A2 SUBSTITUTED PIPERAZINE COMPOUNDS CV THERAPEUTICS, INC. (US) 2001-08-30 WO disclosed
US-5173535-A PLASTICS CONTAINING SUSTAINED RELEASE OF FUNCTIONAL MATERIALS DOW CORNING CORPORATION (US) 1992-12-22 US disclosed
EP-0328145-A2 Plastics containing discrete particles with functional materials DOW CORNING CORPORATION (US) 1989-08-16 EP disclosed
US-4138411-A RUTHENIUM OR OSMIUM CATALYST RHONE-POULENC S. A. (FR) 1979-02-06 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 (4 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-20010041704-A1 N-(2,6-dimethylphenyl)-2-(4-(2-hydroxy-4-phenylbutyl) -piperazinyl)acetamide, for example; useful to protect skeletal muscles against damage from trauma or disease, treat shock, preserve donor tissue or organs; greater half-life TNNC1, ATP2A1, ATP2A2 ESR1 4835/4885SLC6A2 1864/4885SLC6A4 2866/4885
US-20230322647-A1 PCNHCP METAL COMPLEXES AND USES THEREOF PIN4, HIRIP3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ESR1 1822/4885SLC6A2 1112/4885SLC6A4 1063/4885
US-20010036961-A1 Substituted alkylene diamine compounds TNNC1, CPT1B, TNNI3 ESR1 4752/4885SLC6A2 2150/4885SLC6A4 3568/4885
US-12441669-B2 PCNHCP metal complexes and uses thereof PIN4, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HIRIP3 ESR1 2135/4885SLC6A2 922/4885SLC6A4 909/4885

“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.