SCHEMBL7593068

SCHEMBL7593068

CC(C)C1=CC(=C(c2ccccc2)c2ccccc2)[C]=C1C1c2ccccc2-c2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
PTPN1 P18031 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
SCHEMBL7595432 0.85 PTPN1 (0.33) MEN1POLBKMT2AATMPTPN1
SCHEMBL7594417 0.82 MEN1 (0.31) MEN1KMT2A
SCHEMBL7597591 0.70
SCHEMBL7592004 0.69 HTR2A (0.32)
SCHEMBL9018607 0.65 SLC6A2 (0.33) MEN1POLBKMT2AATMPTPN1
SCHEMBL7030170 0.65 POLB (0.34) POLB
SCHEMBL10455248 0.61 POLB (0.33) POLB
SCHEMBL28856362 0.58 GABRA1 (0.41) MEN1POLBKMT2AATM
SCHEMBL3435565 0.58 HTR2A (0.31)
SCHEMBL3209968 0.57 CYP1A2 (0.39) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020052446-A1 Composition based on monofluorometal complexes BAYER AKTIENGESELLSCHAFT (DE) 2002-05-02 US disclosed