SCHEMBL21136583

SCHEMBL21136583

COC(=O)CC(F)(C(=O)OC1CCCCC1)S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.39
CYP19A1 P11511 4/20 0.38
EPHX2 P34913 4/20 0.36
NAAA Q02083 2/20 0.36
HTT P42858 2/20 0.35
CYP2C19 P33261 1/20 0.34
GPR35 Q9HC97 1/20 0.32
GLA P06280 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
RORC P51449 1/20 0.30

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
SCHEMBL21136585 0.86 CYP19A1 (0.40) EPHX1CYP19A1NAAAHTTCYP2C19
SCHEMBL21135924 0.82 EPHX1 (0.42) EPHX1CYP19A1NAAAHTTCYP2C19
SCHEMBL21136586 0.81 EPHX1 (0.36) EPHX1CYP19A1EPHX2NAAAHTT
SCHEMBL21135931 0.80 NAAA (0.41) EPHX1CYP19A1NAAAHTTCYP2C19
SCHEMBL21136394 0.80 EPHX2 (0.38) EPHX2NAAAGLASMN1; SMN2
SCHEMBL21135920 0.78 EPHX1 (0.35) EPHX1CYP19A1NAAAHTTCYP2C19
SCHEMBL21135707 0.76 POLB (0.35) EPHX2NPC1RAB9ASMN1; SMN2
SCHEMBL686576 0.74 CYP19A1 (0.40) EPHX1CYP19A1NAAAHTTCYP2C19
SCHEMBL107383 0.74 CYP19A1 (0.40) EPHX1CYP19A1NAAAHTTCYP2C19
SCHEMBL18785946 0.74 CYP19A1 (0.40) EPHX1CYP19A1NAAAHTTCYP2C19

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-20190196326-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD OF MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2019-06-27 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-20190196326-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD OF MANUFACTURING ELECTRONIC DEVICE RER1, ACTR5, RAD51 EPHX1 139/4885CYP19A1 1662/4885EPHX2 252/4885

“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.