SCHEMBL8094422

SCHEMBL8094422

c1ccc(Cc2ccc(Cc3ccc(Cc4ccccc4)cc3)cc2)cc1

nearest known ligand 0.92

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.92
LTA4H P09960 2/20 0.62
IDH1 O75874 1/20 0.59
PLA2G10 O15496 1/20 0.56
PLA2G2A P14555 1/20 0.56
LMNA P02545 1/20 0.56
SLC22A2 O15244 1/20 0.54
TSHR P16473 3/20 0.50
ALDH1A1 P00352 2/20 0.50
IDO1 P14902 1/20 0.50
TP53 P04637 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.50
BCL2 P10415 1/20 0.50
BCL2L1 Q07817 1/20 0.50
TRPA1 O75762 1/20 0.50

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
SCHEMBL972712 1.00 CALM1 (0.92) CALM1LTA4HIDH1PLA2G10PLA2G2A
Hydrochloric Acid SCHEMBL27978245 0.96 CALM1 (0.86) CALM1LTA4HIDH1PLA2G10PLA2G2A
Diphenylmethane SCHEMBL28172316 0.96 CALM1 (1.00) CALM1LTA4HIDH1PLA2G10PLA2G2A
Diphenylmethane SCHEMBL14763944 0.96 CALM1 (1.00) CALM1LTA4HIDH1PLA2G10PLA2G2A
Diphenylmethane SCHEMBL3792579 0.96 CALM1 (1.00) CALM1LTA4HIDH1PLA2G10PLA2G2A
Diphenylmethane SCHEMBL1303 0.96 CALM1 (1.00) CALM1LTA4HIDH1PLA2G10PLA2G2A
Diphenylmethane SCHEMBL4361124 0.96 CALM1 (1.00) CALM1LTA4HIDH1PLA2G10PLA2G2A
Diphenylmethane SCHEMBL25403056 0.92 CALM1 (0.92) CALM1LTA4HIDH1PLA2G10PLA2G2A
Diphenylmethane SCHEMBL2386917 0.92 CALM1 (0.92) CALM1LTA4HIDH1PLA2G10PLA2G2A
Diphenylmethane SCHEMBL3750008 0.92 CALM1 (0.92) CALM1LTA4HIDH1PLA2G10PLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 US disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed
US-4044139-A FUNGICIDES, BACTERICIDES UNIROYAL, INC. (US) 1977-08-23 US disclosed