SCHEMBL9766756

SCHEMBL9766756

CCc1cc(-c2cc(CC)c(C=O)[nH]2)[nH]c1C=O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.37
GRIN3B O60391 2/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2A Q12879 2/20 0.37
GRIN2B Q13224 2/20 0.37
GRIN2C Q14957 2/20 0.37
GRIN3A Q8TCU5 2/20 0.37
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 1/20 0.30
POLB P06746 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
SCHEMBL8194395 0.85 PTPN1 (0.33) KMT2AALDH1A1
SCHEMBL9766682 0.82 HIF1A (0.38)
SCHEMBL9766749 0.81 HIF1A (0.44) KMT2A
SCHEMBL5358324 0.80 DAO (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8194399 0.77 HCAR2 (0.32)
SCHEMBL9747880 0.75
SCHEMBL9766805 0.71 GRIA1 (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL16510896 0.67 KDM4E (0.35) KMT2AALDH1A1POLB
SCHEMBL15971797 0.66 HCAR2 (0.34) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9735543 0.65 IGF1R (0.37) KMT2AALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5015478-A Treatment of cancer with porphycene CYTOPHARM, INC. (US) 1991-05-14 US disclosed
US-4913907-A LIPOSOMES CYTOPHARM, INC. (US) 1990-04-03 US disclosed