SCHEMBL18600593

SCHEMBL18600593

Nc1cccc2c3ccccc3c3c4ccccc4c4ccccc4c3c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
TSHR P16473 5/20 0.52
HPGD P15428 4/20 0.52
CYP3A4 P08684 4/20 0.52
HSD17B10 Q99714 3/20 0.52
TDP1 Q9NUW8 2/20 0.52
KEAP1 Q14145 2/20 0.50
CYP1A2 P05177 1/20 0.46
THRB P10828 1/20 0.46
ALOX15 P16050 2/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
NFE2L2 Q16236 1/20 0.43
PARP1 P09874 1/20 0.42
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL17781311 0.92 ALDH1A1 (0.50) ALDH1A1TSHRHPGDCYP3A4HSD17B10
SCHEMBL18600594 0.90 ALDH1A1 (0.52) ALDH1A1TSHRHPGDCYP3A4HSD17B10
SCHEMBL1351306 0.89 ALDH1A1 (0.58) ALDH1A1TSHRHPGDCYP3A4HSD17B10
SCHEMBL22990637 0.86 ALDH1A1 (0.61) ALDH1A1TSHRHPGDCYP3A4HSD17B10
SCHEMBL29596758 0.85 KEAP1 (0.45) ALDH1A1TSHRHPGDCYP3A4HSD17B10
SCHEMBL28534201 0.84 HSD17B10 (0.58) ALDH1A1TSHRHPGDCYP3A4HSD17B10
Biphenyl SCHEMBL26686863 0.80 ALDH1A1 (0.48) ALDH1A1TSHRHPGDCYP3A4HSD17B10
SCHEMBL4845687 0.80 CYP1A2 (0.58) ALDH1A1TSHRHPGDCYP3A4HSD17B10
SCHEMBL1978995 0.80 CYP1A2 (0.58) ALDH1A1TSHRHPGDCYP3A4HSD17B10
SCHEMBL11302617 0.80 CYP1A2 (0.58) ALDH1A1TSHRHPGDCYP3A4HSD17B10

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
EP-3141957-B1 RESIST MATERIAL, RESIST COMPOSITION, AND RESIST PATTERN FORMATION METHOD MITSUBISHI GAS CHEMICAL CO (JP) 2021-03-24 EP disclosed
US-10437148-B2 Resist material, resist composition and method for forming resist pattern MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2019-10-08 US disclosed
US-10310377-B2 Material for forming film for lithography, composition for forming film for lithography, film for lithography, pattern forming method and purification method MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2019-06-04 US disclosed
EP-3141959-B1 LITHOGRAPHIC FILM FORMATION MATERIAL, COMPOSITION FOR LITHOGRAPHIC FILM FORMATION, LITHOGRAPHIC FILM, PATTERN FORMATION METHOD, AND PURIFICATION METHOD MITSUBISHI GAS CHEMICAL CO (JP) 2019-01-30 EP disclosed
US-20170145142-A1 RESIST MATERIAL, RESIST COMPOSITION AND METHOD FOR FORMING RESIST PATTERN MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2017-05-25 US disclosed
US-20170144954-A1 MATERIAL FOR FORMING FILM FOR LITHOGRAPHY, COMPOSITION FOR FORMING FILM FOR LITHOGRAPHY, FILM FOR LITHOGRAPHY, PATTERN FORMING METHOD AND PURIFICATION METHOD MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2017-05-25 US disclosed
EP-3141957-A1 RESIST MATERIAL, RESIST COMPOSITION, AND RESIST PATTERN FORMATION METHOD Mitsubishi Gas Chemical Company, Inc. (JP) 2017-03-15 EP disclosed
EP-3141959-A1 LITHOGRAPHIC FILM FORMATION MATERIAL, COMPOSITION FOR LITHOGRAPHIC FILM FORMATION, LITHOGRAPHIC FILM, PATTERN FORMATION METHOD, AND PURIFICATION METHOD Mitsubishi Gas Chemical Company, Inc. (JP) 2017-03-15 EP 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 (2 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-20170144954-A1 MATERIAL FOR FORMING FILM FOR LITHOGRAPHY, COMPOSITION FOR FORMING FILM FOR LITHOGRAPHY, FILM FOR LITHOGRAPHY, PATTERN FORMING METHOD AND PURIFICATION METHOD FRG1, MLLT3, FEM1B ALDH1A1 3533/4885TSHR 3481/4885HPGD 3807/4885
US-10310377-B2 Material for forming film for lithography, composition for forming film for lithography, film for lithography, pattern forming method and purification method FRG1, MLLT3, FEM1B ALDH1A1 3533/4885TSHR 3481/4885HPGD 3807/4885

“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.