SCHEMBL889883

SCHEMBL889883

C/C(=C/CCC(C)O)CCCO

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SQLE Q14534 4/20 0.55
PTPN1 P18031 1/20 0.42
KDM1A O60341 1/20 0.41
ALOX15 P16050 3/20 0.39
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 3/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 2/20 0.36
CYP3A4 P08684 2/20 0.36
UGT1A1 P22309 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ICMT O60725 1/20 0.33

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
SCHEMBL889907 0.88 PTPN1 (0.51) SQLEPTPN1KDM1AALOX15ALDH1A1
SCHEMBL8907996 0.84 KDM1A (0.57) SQLEPTPN1KDM1AKMT2AKDM4E
SCHEMBL1658396 0.84 KDM1A (0.41) SQLEPTPN1KDM1AKMT2AKDM4E
SCHEMBL1658397 0.84 KDM1A (0.41) SQLEPTPN1KDM1AKMT2AKDM4E
SCHEMBL889910 0.83 SQLE (0.39) SQLEPTPN1KDM1AALOX15ALDH1A1
SCHEMBL23787675 0.81 PTPN1 (0.49) SQLEPTPN1KDM1AALOX15ALDH1A1
SCHEMBL8978511 0.81 KDM1A (0.63) SQLEPTPN1KDM1AALOX15ALDH1A1
SCHEMBL8978515 0.81 KDM1A (0.63) SQLEPTPN1KDM1AALOX15ALDH1A1
SCHEMBL3376001 0.81 LSS (0.40) SQLEKDM1AKMT2AMAPTMEN1
SCHEMBL3375999 0.81 LSS (0.40) SQLEKDM1AKMT2AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9193872-B2 Photo-crosslinkable antifouling compositions, films obtained from said compositions, and corresponding uses CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2015-11-24 US disclosed
US-20110268689-A1 PHOTO-CROSSLINKABLE ANTIFOULING COMPOSITIONS, FILMS OBTAINED FROM SAID COMPOSITIONS, AND CORRESPONDING USES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) 2011-11-03 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-20110268689-A1 PHOTO-CROSSLINKABLE ANTIFOULING COMPOSITIONS, FILMS OBTAINED FROM SAID COMPOSITIONS, AND CORRESPONDING USES ALG1, ALG8, PHOSPHO1 SQLE 94/4885PTPN1 3168/4885KDM1A 3988/4885

“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.