SCHEMBL5378450

SCHEMBL5378450

OCCCCCCN(CCCCCCO)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.41
OPRL1 P41146 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SIGMAR1 Q99720 2/20 0.38
NPC1 O15118 1/20 0.38
JAK2 O60674 1/20 0.38
RAB9A P51151 1/20 0.38
PAX8 Q06710 1/20 0.38
KDM4E B2RXH2 2/20 0.37
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
KCNA3 P22001 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HDAC2 Q92769 4/20 0.36
HDAC8 Q9BY41 4/20 0.36
HDAC6 Q9UBN7 3/20 0.36
HDAC3 O15379 2/20 0.36
HDAC4 P56524 2/20 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
SCHEMBL6804765 1.00 OPRM1 (0.41) OPRM1OPRL1MEN1KMT2ASIGMAR1
SCHEMBL5928136 0.98 OPRM1 (0.42) OPRM1OPRL1MEN1KMT2ASIGMAR1
SCHEMBL1408147 0.91 MEN1 (0.42) OPRM1OPRL1MEN1KMT2AKDM4E
SCHEMBL11309971 0.91 ADRA2C (0.39) OPRM1OPRL1MEN1KMT2ASIGMAR1
SCHEMBL25331808 0.88 CNR2 (0.46) OPRM1OPRL1MEN1KMT2ANPC1
SCHEMBL10650204 0.88 TSHR (0.48) OPRM1OPRL1MEN1KMT2ANPC1
SCHEMBL10652285 0.88 TSHR (0.48) OPRM1OPRL1MEN1KMT2ANPC1
SCHEMBL10650134 0.87 TSHR (0.52) OPRM1KMT2ASIGMAR1NPC1RAB9A
SCHEMBL10653978 0.87 TSHR (0.52) OPRM1KMT2ASIGMAR1NPC1RAB9A
SCHEMBL7324210 0.86 TSHR (0.50) OPRM1OPRL1MEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7094929-B2 Water-soluble distyrylbenzene chromophores for applications in optoelectronic technologies THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-08-22 US claimed
US-7232913-B2 Paracyclophane molecules for two-photon absorption applications THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-06-19 US disclosed
US-7232913-B2 Paracyclophane molecules for two-photon absorption applications THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-06-19 US disclosed
US-20060208235-A1 Paracyclophane molecules for two-photon absorption applications MITSUBISHI CHEMICAL COMPANY (JP) 2006-09-21 US disclosed
US-7094929-B2 Water-soluble distyrylbenzene chromophores for applications in optoelectronic technologies THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2006-08-22 US disclosed
US-20040192968-A1 Water-soluble distyrylbenzene chromophores for applications in optoelectronic technologies HANCHUCK TRUST LLC 2004-09-30 US disclosed
EP-0313474-B1 AN OPTICAL ARTICLE EXHIBITING A HIGH LEVEL OF SECOND ORDER POLARIZATION SUSCEPTIBILITY EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1992-12-23 EP disclosed
EP-0313476-B1 AN OPTICAL ARTICLE CONTAINING A POLYMERIC MATRIX EXHIBITING A HIGH LEVEL OF SECOND ORDER POLARIZATION SUSCEPTIBILITY EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1992-12-23 EP disclosed
EP-0313474-A2 An optical article exhibiting a high level of second order polarization susceptibility EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1989-04-26 EP disclosed
EP-0313476-A2 An optical article containing a polymeric matrix exhibiting a high level of second order polarization susceptibility EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1989-04-26 EP disclosed
US-4796971-A CHARGE TRANSFER COMPOUND ON CROSSLINKED MATRIX EASTMAN KODAK COMPANY (US) 1989-01-10 US disclosed
US-4792208-A POLAR ALIGNED NONCENTROSYMMETRIC MOLECULAR DIPOLES; SULFONYL MOIETY AS ELECTRON ACCEPTOR EASTMAN KODAK COMPANY (US) 1988-12-20 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 (2 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-20040192968-A1 Water-soluble distyrylbenzene chromophores for applications in optoelectronic technologies TBCB, CRYAB, CYBA OPRM1 1858/4885OPRL1 949/4885MEN1 4433/4885
US-20060208235-A1 Paracyclophane molecules for two-photon absorption applications SPNS2, SLC35B2, CSPP1 OPRM1 4326/4885OPRL1 3242/4885MEN1 431/4885

“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.