SCHEMBL18574373

SCHEMBL18574373

CCOCc1ccc(C(C)(C)S)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.36
▸ ESR1 P03372 3/20 0.35
▸ ESR2 Q92731 3/20 0.35
▸ IDO1 P14902 2/20 0.34
▸ PTPN2 P17706 1/20 0.34
▸ PTPN1 P18031 1/20 0.34
▸ PTPN6 P29350 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ NR4A2 P43354 1/20 0.33
▸ RXRA P19793 1/20 0.33
▸ RXRB P28702 1/20 0.33
▸ KMT2A Q03164 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ CHRM3 P20309 1/20 0.31
▸ TRPV1 Q8NER1 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
SCHEMBL18473524 0.85 ESR1 (0.37) APPESR1ESR2IDO1PTPN2
SCHEMBL8251933 0.83 APP (0.50) APPTSHRNPC1RAB9ANR4A2
SCHEMBL18911060 0.80 ESR1 (0.39) APPESR1ESR2IDO1PTPN2
SCHEMBL133476 0.80 TSHR (0.48) IDO1TSHR
SCHEMBL20892298 0.79 APP (0.38) APPESR1ESR2IDO1NR4A2
SCHEMBL10534245 0.78 APP (0.35) APPESR1ESR2IDO1PTPN2
SCHEMBL3434078 0.78 IDO1 (0.59) IDO1PTPN2PTPN1PTPN6KMT2A
SCHEMBL18911061 0.77 ESR1 (0.41) APPESR1ESR2IDO1PTPN2
SCHEMBL8750541 0.77 SHBG (0.55) APPESR1ESR2IDO1PTPN2
SCHEMBL23637632 0.76 TP53 (0.42) ESR1ESR2TSHRKMT2AMEN1

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-10031419-B2 Pattern forming method, composition kit and resist film, manufacturing method of electronic device using these, and electronic device FUJIFILM CORPORATION (JP) 2018-07-24 — — US disclosed
US-20170059990-A1 RADIATION-SENSITIVE OR ACTINIC RAY-SENSITIVE RESIN COMPOSITION, RESIST FILM USING THE SAME, MASK BLANK, RESIST PATTERN FORMING METHOD, ELECTRONIC DEVICE MANUFACTURING METHOD, AND ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2017-03-02 — — US disclosed
Send feedback