SCHEMBL18031806

SCHEMBL18031806

C=C(C)C(=O)OCC(F)(F)C(F)(F)COC(=O)C12CC3CC(CC(O)(C3)C1)C2

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
NPSR1 Q6W5P4 2/20 0.42
ABL1 P00519 1/20 0.42
TSHR P16473 1/20 0.42
RIN1 Q13671 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
NPC1 O15118 5/20 0.39
RAB9A P51151 5/20 0.39
LMNA P02545 1/20 0.39
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 1/20 0.38
HSD11B1 P28845 2/20 0.38
GAA P10253 1/20 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
SCHEMBL18031814 0.87 ALDH1A1 (0.40) ALDH1A1NPSR1LMNA
SCHEMBL18315201 0.84 NPSR1 (0.53) ALDH1A1NPSR1ABL1TSHRRIN1
SCHEMBL17899109 0.84 ALDH1A1 (0.51) ALDH1A1NPSR1ABL1TSHRRIN1
SCHEMBL17899103 0.83 ALDH1A1 (0.48) ALDH1A1NPSR1ABL1TSHRRIN1
SCHEMBL17899095 0.82 ALDH1A1 (0.47) ALDH1A1NPSR1ABL1TSHRRIN1
SCHEMBL18315198 0.81 NPSR1 (0.51) ALDH1A1NPSR1ABL1TSHRRIN1
SCHEMBL18315199 0.81 NPSR1 (0.51) ALDH1A1NPSR1ABL1TSHRRIN1
SCHEMBL7797337 0.81 NPSR1 (0.47) ALDH1A1NPSR1ABL1TSHRRIN1
SCHEMBL685292 0.81 ALDH1A1 (0.53) ALDH1A1NPSR1ABL1TSHRRIN1
SCHEMBL17530059 0.80 ALDH1A1 (0.47) ALDH1A1NPSR1ABL1TSHRRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9671692-B2 Compound, resin and photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-06 US disclosed
US-9671692-B2 Compound, resin and photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-06 US disclosed
US-20160244400-A1 COMPOUND, RESIN AND PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-25 US disclosed
US-20160244400-A1 COMPOUND, RESIN AND PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-25 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-20160244400-A1 COMPOUND, RESIN AND PHOTORESIST COMPOSITION C1R, KISS1R, C1S ALDH1A1 543/4885NPSR1 1620/4885ABL1 1091/4885

“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.