SCHEMBL8063993

SCHEMBL8063993

O=C(O)Cc1ccccc1OP(=O)(O)Cc1cccs1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 2/20 0.45
CAMK2A Q9UQM7 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
POLB P06746 3/20 0.39
HPGD P15428 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
CHRM1 P11229 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CASP6 P55212 1/20 0.38
GAA P10253 1/20 0.38
KLK7 P49862 1/20 0.37
RAB9A P51151 1/20 0.37
AKR1B1 P15121 1/20 0.37
FABP4 P15090 1/20 0.37
FABP5 Q01469 1/20 0.37

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
SCHEMBL8059158 0.79 CXCL8 (0.44) CXCL8CAMK2ATDP1CHRM1AKR1B1
SCHEMBL8046728 0.78 CXCL8 (0.46) CXCL8CAMK2ASMN1; SMN2POLBCHRM1
SCHEMBL8083549 0.78 SRC (0.47) POLBHPGDTDP1MEN1KMT2A
SCHEMBL8046814 0.77 CXCL8 (0.58) CXCL8CAMK2ACHRM1MEN1KMT2A
SCHEMBL8061507 0.76 CXCL8 (0.50) CXCL8CAMK2ACHRM1KMT2ARAB9A
SCHEMBL18607331 0.76 CXCL8 (0.58) CXCL8CAMK2AHPGDTDP1CHRM1
SCHEMBL8058401 0.75 CXCL8 (0.46) CXCL8CAMK2ATDP1CHRM1MEN1
SCHEMBL8063968 0.74 CXCL8 (0.42) CXCL8SMN1; SMN2POLBHPGDTDP1
SCHEMBL8061525 0.74 CXCL8 (0.45) CXCL8CAMK2AHPGDRAB9AFABP4
SCHEMBL20472218 0.74 CXCL8 (0.60) CXCL8CAMK2ATDP1CHRM1AKR1B1

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-6046180-A NAALADase inhibitors GUILFORD PHARMACEUTICALS INC. (US) 2000-04-04 US disclosed