SCHEMBL9190067

SCHEMBL9190067

CC1(C)OC(=O)C(=C(O)C2CCCCC2)C(=O)O1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.46
ACP1 P24666 3/20 0.39
CDC25B P30305 3/20 0.39
LMNA P02545 2/20 0.34
HSD17B10 Q99714 1/20 0.34
TSHR P16473 1/20 0.32
HPGD P15428 1/20 0.32
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
ALDH1A1 P00352 4/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PTGS2 P35354 1/20 0.31
TP53 P04637 1/20 0.31
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL19257801 0.81 PTPN1 (0.42) PTPN1ACP1CDC25BLMNAHSD17B10
SCHEMBL15798299 0.75 PTPN1 (0.46) PTPN1ACP1CDC25BLMNAHSD17B10
SCHEMBL9532715 0.72 PTPN1 (0.47) PTPN1ACP1CDC25BLMNAHSD17B10
SCHEMBL2803500 0.72 PTPN1 (0.46) PTPN1ACP1CDC25BLMNAHSD17B10
SCHEMBL70825 0.69 PTPN1 (0.56) PTPN1ACP1CDC25BLMNAHSD17B10
SCHEMBL21810871 0.68 PTPN1 (0.50) PTPN1ACP1CDC25BLMNAHSD17B10
SCHEMBL7992161 0.68 BACE1 (0.39) TSHRCES2CES1ALDH1A1MAPK1
SCHEMBL8194669 0.68 PTPN1 (0.59) PTPN1ACP1CDC25BLMNAHSD17B10
SCHEMBL3084677 0.67 ALDH1A1 (0.38) LMNAHSD17B10TSHRALDH1A1SMN1; SMN2
SCHEMBL9193677 0.67 PTPN1 (0.44) PTPN1ACP1CDC25BLMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0456073-B1 Multifunctional compounds having alpha-diazo-beta-ketoester units and sulfonic acid ester units and process for their preparation. HOECHST AG (DE) 1995-10-25 EP disclosed
EP-0378067-B1 Positively working radiation-sensitive mixture containing a multifunctional alpha-diazo-beta-keto ester, process for its preparation and a radiation-sensitive recording material containing this mixture HOECHST AG (DE) 1995-05-31 EP disclosed
EP-0501294-B1 Radiation-sensitive polymers with 2-diazo-1,3-dicarbonyl groups, process for its production and its use in a positive-working recording material HOECHST AG (DE) 1994-10-26 EP disclosed
US-5326826-A Binder HOECHST AKTIENGESELLSCHAFT (DE) 1994-07-05 US disclosed
US-5198322-A Positively operating radiation-sensitive mixture containing a polyfunctional α-diazo-β-keto ester and radiation-sensitive recording material containing this mixture HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-30 US disclosed
US-5191069-A Photosensitive compounds with heat resistance HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-02 US disclosed
EP-0501294-A1 Radiation-sensitive polymers with 2-diazo-1,3-dicarbonyl groups, process for its production and its use in a positive-working recording material HOECHST AKTIENGESELLSCHAFT (DE) 1992-09-02 EP disclosed
EP-0456073-A2 Multifunctional compounds having alpha-diazo-beta-ketoester units and sulfonic acid ester units and process for their preparation. HOECHST AKTIENGESELLSCHAFT (DE) 1991-11-13 EP disclosed
EP-0378067-A2 Positively working radiation-sensitive mixture containing a multifunctional alpha-diazo-beta-keto ester, process for its preparation and a radiation-sensitive recording material containing this mixture HOECHST AKTIENGESELLSCHAFT (DE) 1990-07-18 EP disclosed