SCHEMBL16897675

SCHEMBL16897675

CCOC(=O)C(C)CCC=C(C)C

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.51
TSHR P16473 1/20 0.43
ALDH1A1 P00352 4/20 0.42
CYP2D6 P10635 2/20 0.41
CYP2C19 P33261 2/20 0.41
LMNA P02545 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP2C9 P11712 1/20 0.37
USP2 O75604 1/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL14606153 0.90 ALOX15 (0.58) ALOX15TSHRALDH1A1CYP2D6CYP2C19
SCHEMBL16897674 0.82 ALOX15 (0.53) ALOX15TSHRALDH1A1CYP2D6CYP2C19
SCHEMBL17338136 0.82 ALOX15 (0.50) ALOX15TSHRALDH1A1HPGD
SCHEMBL14619573 0.82 ALOX15 (0.40) ALOX15TSHRALDH1A1CYP2D6CYP2C19
SCHEMBL18762326 0.80 ALOX15 (0.47) ALOX15TSHRALDH1A1
SCHEMBL16903608 0.80 ALOX15 (0.47) ALOX15TSHRALDH1A1USP2GLA
SCHEMBL8750502 0.80 ALOX15 (0.47) ALOX15TSHRALDH1A1CYP2D6CYP2C19
SCHEMBL15429377 0.80 MAPT (0.43) ALOX15TSHRALDH1A1CYP2D6CYP2C19
SCHEMBL10406381 0.80 ALDH1A1 (0.37) ALOX15TSHRALDH1A1CYP2D6CYP2C19
SCHEMBL28454942 0.80 MAPT (0.43) ALOX15TSHRALDH1A1CYP2D6CYP2C19

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10280131-B2 Terpene-derived acids and esters and methods for preparing and using same P2 SCIENCE, INC. (US) 2019-05-07 US disclosed
US-10071941-B2 Terpene-derived compounds and methods for preparing and using same P2 SCIENCE, INC. (US) 2018-09-11 US disclosed
US-20170275230-A1 TERPENE-DERIVED ACIDS AND ESTERS AND METHODS FOR PREPARING AND USING SAME P2 SCIENCE, INC. (US) 2017-09-28 US disclosed
US-9682914-B2 Terpene-derived acids and esters and methods for preparing and using same P2 SCIENCE, INC. (US) 2017-06-20 US disclosed
US-20170113988-A1 TERPENE-DERIVED COMPOUNDS AND METHODS FOR PREPARING AND USING SAME P2 SCIENCE, INC. 2017-04-27 US disclosed
EP-3094615-A1 TERPENE-DERIVED ACIDS AND ESTERS AND METHODS FOR PREPARING AND USING SAME P2 Science, Inc. (US) 2016-11-23 EP disclosed
US-20160332952-A1 TERPENE-DERIVED ACIDS AND ESTERS AND METHODS FOR PREPARING AND USING SAME P2 SCIENCE, INC. 2016-11-17 US disclosed
WO-2015191706-A1 TERPENE-DERIVED COMPOUNDS AND METHODS FOR PREPARING AND USING SAME P2 SCIENCE, INC. (US) 2015-12-17 WO disclosed
WO-2015106293-A1 TERPENE-DERIVED ACIDS AND ESTERS AND METHODS FOR PREPARING AND USING SAME P2 SCIENCE, INC. (US) 2015-07-16 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-20160332952-A1 TERPENE-DERIVED ACIDS AND ESTERS AND METHODS FOR PREPARING AND USING SAME GGPS1, CYP51A1, LSS ALOX15 56/4885TSHR 3593/4885ALDH1A1 761/4885
US-20170113988-A1 TERPENE-DERIVED COMPOUNDS AND METHODS FOR PREPARING AND USING SAME MSMO1, ERG28, CYP51A1 ALOX15 120/4885TSHR 3317/4885ALDH1A1 3407/4885
US-10280131-B2 Terpene-derived acids and esters and methods for preparing and using same GGPS1, CYP51A1, LSS ALOX15 56/4885TSHR 3593/4885ALDH1A1 761/4885
US-20170275230-A1 TERPENE-DERIVED ACIDS AND ESTERS AND METHODS FOR PREPARING AND USING SAME GGPS1, CYP51A1, LSS ALOX15 56/4885TSHR 3593/4885ALDH1A1 761/4885
US-10071941-B2 Terpene-derived compounds and methods for preparing and using same MSMO1, ERG28, CYP51A1 ALOX15 120/4885TSHR 3317/4885ALDH1A1 3407/4885

“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.