SCHEMBL10845643

SCHEMBL10845643

CCCC(=O)C=Cc1ccccc1O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IAPP P10997 5/20 0.76
MAPT P10636 3/20 0.62
LMNA P02545 1/20 0.62
NFKB1 P19838 2/20 0.61
NFE2L2 Q16236 2/20 0.61
JUN P05412 1/20 0.61
CA1 P00915 1/20 0.59
CA2 P00918 1/20 0.59
CA4 P22748 1/20 0.59
BCHE P06276 1/20 0.54
GUSB P08236 1/20 0.54
MAPK1 P28482 2/20 0.51
KDM4E B2RXH2 1/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
ATM Q13315 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
CHRNA7 P36544 3/20 0.50
CYP1A1 P04798 1/20 0.48

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
SCHEMBL10845639 1.00 IAPP (0.76) IAPPMAPTLMNANFKB1NFE2L2
SCHEMBL16576811 0.89 NFKB1 (0.70) IAPPMAPTLMNANFKB1NFE2L2
SCHEMBL10847763 0.87 IAPP (0.75) IAPPMAPTLMNANFKB1NFE2L2
SCHEMBL10847770 0.87 IAPP (0.75) IAPPMAPTLMNANFKB1NFE2L2
SCHEMBL3508745 0.85 NFKB1 (0.70) IAPPMAPTLMNANFKB1NFE2L2
SCHEMBL3508748 0.85 NFKB1 (0.70) IAPPMAPTLMNANFKB1NFE2L2
SCHEMBL2437376 0.84 IAPP (0.64) IAPPMAPTLMNANFKB1NFE2L2
SCHEMBL2437375 0.84 IAPP (0.64) IAPPMAPTLMNANFKB1NFE2L2
SCHEMBL2473767 0.84 IAPP (0.64) IAPPMAPTLMNANFKB1NFE2L2
SCHEMBL2441185 0.84 IAPP (0.64) IAPPMAPTLMNANFKB1NFE2L2

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-4611070-A DYE-FORMING COMPONENTS FOR PRESSURE-SENSITIVE RECORDING OR COPYING BASF AKTIENGESELLSCHAFT (DE) 1986-09-09 US disclosed
EP-0010740-B1 SPIRODIPYRANES AND THEIR USE AS COLOUR FORMERS IN COPYING PROCESSES BASF Aktiengesellschaft (DE) 1982-04-21 EP disclosed
EP-0010740-A1 Spirodipyranes and their use as colour formers in copying processes BASF Aktiengesellschaft (DE) 1980-05-14 EP disclosed