SCHEMBL3160

SCHEMBL3160

COc1ccc(CC(C)C(C)Cc2ccc(O)c(O)c2)cc1O

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 7/20 0.90
ALOX12 P18054 7/20 0.90
CYP3A4 P08684 3/20 0.73
MEN1 O00255 3/20 0.73
KMT2A Q03164 3/20 0.73
KDM4E B2RXH2 2/20 0.73
ALDH1A1 P00352 2/20 0.73
ESR1 P03372 2/20 0.73
TP53 P04637 2/20 0.73
HPGD P15428 2/20 0.73
MAPK1 P28482 2/20 0.73
RECQL P46063 2/20 0.73
HIF1A Q16665 2/20 0.73
HSD17B10 Q99714 2/20 0.73
NR3C1 P04150 2/20 0.73
FOS P01100 2/20 0.73
TTR P02766 2/20 0.73
JUN P05412 2/20 0.73
HSD17B1 P14061 2/20 0.73
HSD17B2 P37059 2/20 0.73

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
Dimethylnordihydroguarierate Acid SCHEMBL22039401 0.95 ALOX15 (1.00) ALOX15ALOX12CYP3A4MEN1KMT2A
SCHEMBL22040032 0.92 ALOX15 (1.00) ALOX15ALOX12CYP3A4MEN1KMT2A
SCHEMBL29929344 0.90 ALOX15 (1.00) ALOX15ALOX12CYP3A4MEN1KMT2A
SCHEMBL4640898 0.90 ALOX15 (0.90) ALOX15ALOX12CYP3A4MEN1KMT2A
SCHEMBL13309003 0.90 ALOX15 (1.00) ALOX15ALOX12CYP3A4MEN1KMT2A
SCHEMBL29794171 0.90 ALOX15 (1.00) ALOX15ALOX12CYP3A4MEN1KMT2A
SCHEMBL4639890 0.90 ALOX15 (1.00) ALOX15ALOX12CYP3A4MEN1KMT2A
SCHEMBL26300965 0.87 ALOX15 (0.84) ALOX15ALOX12CYP3A4MEN1KMT2A
Nordihydroguaiaretic Acid SCHEMBL135976 0.86 ALOX15 (1.00) ALOX15ALOX12CYP3A4MEN1KMT2A
Nordihydroguaiaretic Acid SCHEMBL13906133 0.86 ALOX15 (1.00) ALOX15ALOX12CYP3A4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE40246-E1 Method for the suppression of viral growth JOHN HOPKINS UNIVERSITY (US) 2008-04-15 US claimed
EP-3663295-A1 2,6-DIOXO,-2,3-DIHYDRO-1H-PURINE COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO THE ACTIVITY OF THE TRPA1 CHANNEL ELI LILLY AND CO. (US) 2020-06-10 EP disclosed
EP-3184527-B1 2,6-DIOXO,-2,3-DIHYDRO-1H-PURINE COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO THE ACTIVITY OF THE TRPA1 CHANNEL LILLY CO ELI (US) 2020-01-29 EP disclosed
US-10351567-B2 Methods and compositions for treating pain ELI LILLY AND COMPANY (US) 2019-07-16 US disclosed
US-20180133170-A1 METHODS AND COMPOSITIONS FOR TREATING DISORDERS ELI LILLY AND COMPANY 2018-05-17 US disclosed
US-20180093986-A1 METHODS AND COMPOSITIONS FOR TREATING PAIN HYDRA BIOSCIENCES, INC. (US) 2018-04-05 US disclosed
US-20180051020-A1 COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO TRPA1 HYDRA BIOSCIENCES INC (US) 2018-02-22 US disclosed
US-9815838-B2 Methods and compositions for treating pain HYDRA BIOSCIENCES, INC. (US) 2017-11-14 US disclosed
US-20170224687-A1 COMPOUNDS FOR MODULATING TRPV3 FUNCTION HYDRA BIOSCIENCES INC (US) 2017-08-10 US disclosed
EP-3184527-A1 2,6-DIOXO,-2,3-DIHYDRO-1H-PURINE COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO THE ACTIVITY OF THE TRPA1 CHANNEL Hydra Biosciences, Inc. (US) 2017-06-28 EP disclosed
US-20060141046-A1 Particles for the delivery of active agents IVREA PHARMACEUTICALS, INC. (US) 2006-06-29 US disclosed
US-20050281886-A1 Particles for the delivery of active agents IVREA PHARMACEUTICALS, INC. (US) 2005-12-22 US disclosed
WO-2005107710-A2 PARTICLES FOR THE DELIVERY OF ACTIVE AGENTS IVREA PHARMACEUTICALS, INC. (US) 2005-11-17 WO disclosed
US-6365787-B1 CREOSOTE BUSH LARREA TRIDENTATA EXTRACTS OF 1,4-BIS-(3,4-DIHYDROXY-PHENYL)-2,3-DIMETHYLBUTANE DERIVATIVES THE JOHNS HOPKINS UNIVERSITY 2002-04-02 US disclosed
US-6291524-B1 HYDROXY-, METHOXY- AND ACETOXY-DERIVATIVES OF 2,3-DIMETHYL-1,4-DIPHENYLBUTANE JOHNS HOPKINS UNIVERSITY 2001-09-18 US disclosed
US-5663209-A Compounds for the suppression of HIV Tat transactivation THE JOHNS HOPKINS UNIVERSITY (US) 1997-09-02 US disclosed
EP-0783474-A4 1997-08-27 EP disclosed
EP-0783474-A1 COMPOUNDS FOR THE SUPPRESSION OF HIV TAT TRANSACTIVATION THE JOHNS-HOPKINS UNIVERSITY (US) 1997-07-16 EP disclosed
WO-1996010549-A9 COMPOUNDS FOR THE SUPPRESSION OF HIV TAT TRANSACTIVATION 1996-06-06 WO disclosed
WO-1996010549-A1 COMPOUNDS FOR THE SUPPRESSION OF HIV TAT TRANSACTIVATION THE JOHNS-HOPKINS UNIVERSITY (US) 1996-04-11 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 (5 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-20180051020-A1 COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO TRPA1 TRPA1, TRPV1, TRPV2 ALOX15 298/4885ALOX12 246/4885CYP3A4 2908/4885
US-20170224687-A1 COMPOUNDS FOR MODULATING TRPV3 FUNCTION TRPV3, TRPV1, TRPV4 ALOX15 1047/4885ALOX12 736/4885CYP3A4 3177/4885
US-20180133170-A1 METHODS AND COMPOSITIONS FOR TREATING DISORDERS TRPA1, TRPV1, TRPV3 ALOX15 148/4885ALOX12 90/4885CYP3A4 2805/4885
US-10351567-B2 Methods and compositions for treating pain ACHE, COL2A1, MMP8 ALOX15 91/4885ALOX12 66/4885CYP3A4 3970/4885
US-20180093986-A1 METHODS AND COMPOSITIONS FOR TREATING PAIN ACHE, COL2A1, MMP8 ALOX15 91/4885ALOX12 66/4885CYP3A4 3970/4885

“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.