SCHEMBL1289353

SCHEMBL1289353

CCCCCCC(O)CCCCCCCCCCCNCCCC

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
ALDH1A1 P00352 1/20 0.56
FFAR4 Q5NUL3 1/20 0.52
FFAR1 O14842 1/20 0.52
FAAH O00519 2/20 0.49
GPR84 Q9NQS5 5/20 0.48
S1PR2 O95136 5/20 0.47
S1PR4 O95977 5/20 0.47
S1PR1 P21453 5/20 0.47
S1PR3 Q99500 5/20 0.47
S1PR5 Q9H228 1/20 0.47
NFKB1 P19838 1/20 0.46
EPHX1 P07099 2/20 0.43

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
SCHEMBL19066838 0.98 ALDH1A1 (0.59) TSHRALDH1A1FFAR4FFAR1FAAH
SCHEMBL19066837 0.98 ALDH1A1 (0.59) TSHRALDH1A1FFAR4FFAR1FAAH
SCHEMBL1289280 0.98 ALDH1A1 (0.59) TSHRALDH1A1FFAR4FFAR1FAAH
SCHEMBL9880954 0.98 ALDH1A1 (0.59) TSHRALDH1A1FFAR4FFAR1FAAH
SCHEMBL748528 0.96 ALDH1A1 (0.56) TSHRALDH1A1FFAR4FFAR1FAAH
SCHEMBL27828680 0.96 FFAR4 (0.52) TSHRALDH1A1FFAR4FFAR1FAAH
SCHEMBL7086817 0.96 ALDH1A1 (0.56) TSHRALDH1A1FFAR4FFAR1FAAH
Ethylene SCHEMBL11903760 0.94 ALDH1A1 (0.54) TSHRALDH1A1FFAR4FFAR1FAAH
SCHEMBL29894248 0.94 ALDH1A1 (0.54) TSHRALDH1A1FFAR4FFAR1FAAH
SCHEMBL1687579 0.94 ALDH1A1 (0.54) TSHRALDH1A1FFAR4FFAR1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9708521-B2 Systems and methods employing low molecular weight gelators for crude oil, petroleum product or chemical spill containment and remediation GEORGETOWN UNIVERSITY (US) 2017-07-18 US disclosed
US-9109150-B2 Fast recovery of thixotropy by organogels with low molecular weight gelators GEORGETOWN UNIVERSITY (US) 2015-08-18 US disclosed
EP-2609066-A1 LOW MOLECULAR WEIGHT GELATORS FOR CRUDE OIL, PETROLEUM PRODUCT OR CHEMICAL SPILL CONTAINMENT Georgetown University (US) 2013-07-03 EP disclosed
US-20120136074-A1 SYSTEMS AND METHODS EMPLOYING LOW MOLECULAR WEIGHT GELATORS FOR CRUDE OIL, PETROLEUM PRODUCT OR CHEMICAL SPILL CONTAINMENT AND REMEDIATION GEORGETOWN UNIVERSITY (US) 2012-05-31 US disclosed
WO-2012047251-A1 LOW MOLECULAR WEIGHT GELATORS FOR CRUDE OIL, PETROLEUM PRODUCT OR CHEMICAL SPILL CONTAINMENT GEORGETOWN UNIVERSITY (US) 2012-04-12 WO disclosed
US-20110251294-A1 FAST RECOVERY OF THIXOTROPY BY ORGANOGELS WITH LOW MOLECULAR WEIGHT GELATORS GEORGETOWN UNIVERSITY (US) 2011-10-13 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-20110251294-A1 FAST RECOVERY OF THIXOTROPY BY ORGANOGELS WITH LOW MOLECULAR WEIGHT GELATORS TBXAS1, TBXA2R, TSNAX TSHR 51/4885ALDH1A1 1454/4885FFAR4 1409/4885

“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.