SCHEMBL17617825

SCHEMBL17617825

CC(C)Sc1ccc2c3c(cccc13)C(=O)OC2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 5/20 0.51
▸ BCL2 P10415 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PABPC1 P11940 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MAP2K7 O14733 1/20 0.37
▸ CDC25A P30304 1/20 0.37
▸ CDC25B P30305 1/20 0.37
▸ ALOX15 P16050 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ FGFR1 P11362 1/20 0.36
▸ MCL1 Q07820 1/20 0.35
▸ ELANE P08246 1/20 0.35
▸ KEAP1 Q14145 2/20 0.34
▸ NFE2L2 Q16236 2/20 0.34
▸ USP2 O75604 1/20 0.34

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
SCHEMBL17617827 0.81 KMT2A (0.56) BCL2MEN1KMT2APOLBKDM4E
SCHEMBL17617826 0.80 POLB (0.55) TYMSBCL2MEN1KMT2APOLB
SCHEMBL17617816 0.75 TYMS (0.62) TYMSBCL2MEN1KMT2APOLB
SCHEMBL15702319 0.75 TYMS (0.56) TYMSMEN1KMT2APOLBKDM4E
SCHEMBL10267341 0.74 TYMS (0.70) TYMSMEN1KMT2APOLBKDM4E
SCHEMBL11346047 0.74 BCL2 (0.60) TYMSBCL2KDM4EMAPTALOX15
SCHEMBL9450641 0.74 CDK5 (0.50) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL17617836 0.74 KMT2A (0.43) BCL2MEN1KMT2APOLBKDM4E
SCHEMBL1354118 0.73 TYMS (0.60) TYMSBCL2MEN1KMT2APOLB
SCHEMBL19014926 0.72 PRMT1 (0.39) TYMSBCL2MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3182203-A1 A COMBINATION OF NIT DERIVATIVES WITH SENSITIZERS Heraeus Precious Metals North America Daychem LLC (US) 2017-06-21 — — EP disclosed
US-9383644-B2 Sulfonic acid derivative compounds as photoacid generators in resist applications Heraeus Precious Metals North America Daychem LLC (US) 2016-07-05 — — US disclosed
US-9383644-B2 Sulfonic acid derivative compounds as photoacid generators in resist applications Heraeus Precious Metals North America Daychem LLC (US) 2016-07-05 — — US disclosed
WO-2016043941-A1 SULFONIC DERIVATIVE COMPOUNDS AS PHOTOACID GENERATORS IN RESIST APPLICATIONS Heraeus Precious Metals North America Daychem LLC (US) 2016-03-24 — — WO disclosed
US-20160085148-A1 SULFONIC ACID DERIVATIVE COMPOUNDS AS PHOTOACID GENERATORS IN RESIST APPLICATIONS HERAEUS EPURIO LLC 2016-03-24 — — US disclosed
US-20160085148-A1 SULFONIC ACID DERIVATIVE COMPOUNDS AS PHOTOACID GENERATORS IN RESIST APPLICATIONS HERAEUS EPURIO LLC 2016-03-24 — — US disclosed
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