SCHEMBL17550601

SCHEMBL17550601

CC(C)C(=O)OCCOC(=O)C(F)(F)C(=O)OC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.36
CYP17A1 P05093 2/20 0.36
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
EPHX2 P34913 1/20 0.32
NAAA Q02083 1/20 0.31
TSHR P16473 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
SCHEMBL17545758 0.89 CYP19A1 (0.36) CYP19A1CYP17A1MEN1KMT2ANPSR1
SCHEMBL13556146 0.88 CYP19A1 (0.34) CYP19A1CYP17A1MEN1KMT2ANPSR1
SCHEMBL17545744 0.87 CYP19A1 (0.34) CYP19A1CYP17A1MEN1KMT2ANPSR1
SCHEMBL17550599 0.86 CYP19A1 (0.40) CYP19A1CYP17A1MEN1KMT2ANPSR1
SCHEMBL2625597 0.83 CYP19A1 (0.38) CYP19A1CYP17A1MEN1KMT2ANPSR1
SCHEMBL10171138 0.82 THRB (0.38) CYP19A1CYP17A1MEN1KMT2ANPSR1
SCHEMBL10171137 0.80 TSHR (0.39) CYP19A1CYP17A1NPSR1ALDH1A1HTT
SCHEMBL17548753 0.78 CYP19A1 (0.34) CYP19A1CYP17A1MEN1KMT2ANPSR1
SCHEMBL17548756 0.76 CYP17A1 (0.33) CYP19A1CYP17A1MEN1KMT2AALDH1A1
SCHEMBL13556142 0.76 CYP17A1 (0.33) CYP19A1CYP17A1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9760005-B2 Salt, acid generator, resist composition and method for producing resist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-09-12 US disclosed
US-9671692-B2 Compound, resin and photoresist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-06 US disclosed
US-9645490-B2 Salt, acid generator, photoresist composition, and method for producing photoresist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-05-09 US disclosed
US-20160244400-A1 COMPOUND, RESIN AND PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-25 US disclosed
US-20160170298-A1 SALT, ACID GENERATOR, PHOTORESIST COMPOSITION, AND METHOD FOR PRODUCING PHOTORESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-06-16 US disclosed
US-20160139508-A1 COMPOUND, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-05-19 US disclosed
US-20160131971-A1 COMPOUND, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-05-12 US disclosed
US-20160062233-A1 SALT, ACID GENERATOR, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-03-03 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 (5 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-20160062233-A1 SALT, ACID GENERATOR, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN XDH, HAX1, MLX CYP19A1 328/4885CYP17A1 119/4885MEN1 3032/4885
US-20160244400-A1 COMPOUND, RESIN AND PHOTORESIST COMPOSITION C1R, KISS1R, C1S CYP19A1 757/4885CYP17A1 1410/4885MEN1 2795/4885
US-20160131971-A1 COMPOUND, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN RER1, RXRA, C1R CYP19A1 923/4885CYP17A1 2057/4885MEN1 4136/4885
US-20160139508-A1 COMPOUND, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN AFF1, AFF2, AFF4 CYP19A1 630/4885CYP17A1 1257/4885MEN1 4160/4885
US-20160170298-A1 SALT, ACID GENERATOR, PHOTORESIST COMPOSITION, AND METHOD FOR PRODUCING PHOTORESIST PATTERN FGFR1, PKD1, KCNA1 CYP19A1 702/4885CYP17A1 1037/4885MEN1 1163/4885

“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.