SCHEMBL9975650

SCHEMBL9975650

CCCCCCCCCC(CCCCCCCCC)C(CCCCCCCCC)CCCCCCCCN=C=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.47
MAPT P10636 1/20 0.38
GPR84 Q9NQS5 7/20 0.37
FDPS P14324 3/20 0.35
FFAR1 O14842 1/20 0.35
LMNA P02545 1/20 0.34
LCK P06239 1/20 0.34
PPARD Q03181 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH4 P08319 1/20 0.33
ADH7 P40394 1/20 0.33
LAP3 P28838 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
DNM1 Q05193 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
SCHEMBL13069624 1.00 NAAA (0.47) NAAAMAPTGPR84FDPSFFAR1
SCHEMBL1123429 1.00 NAAA (0.47) NAAAMAPTGPR84FDPSFFAR1
SCHEMBL13105852 0.91 NAAA (0.40) NAAAMAPTGPR84FDPSFFAR1
SCHEMBL9975653 0.90 TSHR (0.41) NAAAMAPTGPR84FDPSFFAR1
SCHEMBL11321426 0.88 NAAA (0.47) NAAAMAPTGPR84FDPSFFAR1
SCHEMBL527174 0.87 NAAA (0.58) NAAAGPR84LMNAPPARDMEN1
SCHEMBL37419 0.87 NAAA (0.58) NAAAGPR84LMNAPPARDMEN1
SCHEMBL10791564 0.87 NAAA (0.58) NAAAGPR84LMNAPPARDMEN1
SCHEMBL15486455 0.87 NAAA (0.58) NAAAGPR84LMNAPPARDMEN1
SCHEMBL5575642 0.87 NAAA (0.58) NAAAGPR84LMNAPPARDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120157562-A1 UREA-URETHANE GELLANT COMPOSITIONS WITH CONTROLLED MOLECULAR WEIGHT AND METHODS OF PREPARATION XEROX CORPORATION (US) 2012-06-21 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-20120157562-A1 UREA-URETHANE GELLANT COMPOSITIONS WITH CONTROLLED MOLECULAR WEIGHT AND METHODS OF PREPARATION UGP2, PUF60, UBA7 NAAA 891/4885MAPT 133/4885GPR84 4343/4885

“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.