SCHEMBL17828628

SCHEMBL17828628

CC(F)(F)COC(=O)C12CC3CC(C1)C1(OCCCO1)C(C3)C2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ATM Q13315 1/20 0.37
CYP17A1 P05093 3/20 0.34
CYP19A1 P11511 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MAPT P10636 2/20 0.34
PRKCA P17252 1/20 0.33
PKM P14618 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 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
SCHEMBL12932552 0.95 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL17279355 0.88 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL17279353 0.88 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL17899099 0.88 MEN1 (0.34) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL24361225 0.87 ALDH1A1 (0.34) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL16941880 0.86 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL17831597 0.85 PKM (0.33) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL17548717 0.85 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL18031816 0.84 ALDH1A1 (0.33) ALDH1A1MEN1KMT2AATMCYP17A1
SCHEMBL25454582 0.83 MEN1 (0.33) ALDH1A1MEN1KMT2AATMCYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9771346-B2 Salt, acid generator, resist composition and method for producing resist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-09-26 US disclosed
US-20160168115-A1 SALT, ACID GENERATOR, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-06-16 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-20160168115-A1 SALT, ACID GENERATOR, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN FGFR1, RER1, FRG1 ALDH1A1 1201/4885MEN1 357/4885KMT2A 699/4885

“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.