SCHEMBL11236853

SCHEMBL11236853

COP(=O)(O)c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.41
MMP2 P08253 2/20 0.38
MMP8 P22894 2/20 0.38
MMP14 P50281 2/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
LMNA P02545 2/20 0.37
TSHR P16473 1/20 0.37
CA2 P00918 1/20 0.36
MMP9 P14780 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
MMP1 P03956 1/20 0.35
CYP2A6 P11509 1/20 0.35

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
SCHEMBL11813178 0.82 MMP2 (0.41) ALOX15MMP2MMP8MMP14MEN1
SCHEMBL914714 0.82 NPC1 (0.48) MMP2MMP8MMP14HPGDMEN1
SCHEMBL18417833 0.78 CA1 (0.48) ALOX15MMP2HPGDNPC1CA2
SCHEMBL11804299 0.77 ALOX15 (0.43) ALOX15HPGDMEN1KMT2ANPC1
SCHEMBL344018 0.77 CA2 (0.54) ALOX15MEN1KMT2APOLBLMNA
Hydrochloric Acid SCHEMBL11034039 0.76 CA2 (0.52) ALOX15MEN1KMT2APOLBLMNA
SCHEMBL9584053 0.76 CA2 (0.52) ALOX15MEN1KMT2APOLBLMNA
SCHEMBL28351298 0.75 CA1 (0.50) ALOX15HPGDKMT2ATSHRCA2
SCHEMBL14204720 0.75 ENPP2 (0.47) LMNATSHRCA2CA14
SCHEMBL11651162 0.75 MMP2 (0.42) ALOX15MMP2MMP8MMP14HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4318783-A Process for the preparation of optionally substituted benzaldehyde dialkyl acetals BAYER AKTIENGESELLSCHAFT (DE) 1982-03-09 US disclosed
EP-0012240-B1 PROCESS FOR MANUFACTURING OF OPTIONALLY SUBSTITUTED BENZALDEHYD-DIALKYL ACETALS BAYER AG (DE) 1982-01-20 EP disclosed
EP-0012240-A2 Process for manufacturing of optionally substituted benzaldehyd-dialkyl acetals BAYER AG (DE) 1980-06-25 EP disclosed