SCHEMBL2815894

SCHEMBL2815894

CCCCCCC(Cl)Cl.S=C=S

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.44
LMNA P02545 1/20 0.41
DNM1 Q05193 2/20 0.40
TSHR P16473 2/20 0.40
THRB P10828 1/20 0.40
OPRM1 P35372 1/20 0.39
ALDH1A1 P00352 1/20 0.38
FDPS P14324 3/20 0.37
GPR84 Q9NQS5 2/20 0.37

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
Hexane SCHEMBL1145162 0.89 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
SCHEMBL26106 0.89
SCHEMBL688498 0.89 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
Hexane SCHEMBL3754301 0.89 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
SCHEMBL16969849 0.89 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
SCHEMBL977939 0.89 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
SCHEMBL154425 0.89 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
Hexane SCHEMBL1525236 0.89 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
Heptane SCHEMBL15226631 0.89 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1
SCHEMBL7574727 0.89 TSHR (0.50) LMNADNM1TSHRTHRBOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8669359-B2 Electrically conducting porphyrin and porphyrin-fullerene electropolymers ARIZONA BOARD OF REGENTS FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2014-03-11 US disclosed
US-20100065123-A1 Electrically conducting porphyrin and porphyrin-fullerene electropolymers UNITED STATES DEPARTMENT OF ENERGY 2010-03-18 US disclosed
WO-2008109467-A1 ELECTRICALLY CONDUCTING PORPHYRIN AND PORPHYRIN-FULLERENE ELECTROPOLYMERS ARIZONA BOARD OF REGENTS FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2008-09-12 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 (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-20100065123-A1 Electrically conducting porphyrin and porphyrin-fullerene electropolymers HMBS, PPOX, SLC40A1 NAAA 3677/4885LMNA 3840/4885DNM1 753/4885

“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.