SCHEMBL7120573

SCHEMBL7120573

CCCCc1ccc(NC(=O)c2c(O)c(Cl)cc(Cl)c2O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ TRPV1 Q8NER1 1/20 0.53
▸ NPC1 O15118 4/20 0.53
▸ RAB9A P51151 4/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ ALDH1A1 P00352 3/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ NFKB2 Q00653 1/20 0.53
▸ RELA Q04206 1/20 0.53
▸ POLB P06746 1/20 0.52
▸ KDM4E B2RXH2 2/20 0.51
▸ AKR1C2 P52895 1/20 0.51
▸ AKR1C1 Q04828 1/20 0.51
▸ HPGD P15428 2/20 0.50
▸ STING1 Q86WV6 1/20 0.49
▸ ACLY P53396 1/20 0.48
▸ GALR3 O60755 1/20 0.47
▸ CA12 O43570 1/20 0.47
▸ CA1 P00915 1/20 0.47

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
SCHEMBL7762753 0.95 TRPV1 (0.62) TP53GAATRPV1NPC1RAB9A
SCHEMBL7119485 0.86 LMNA (0.54) TP53GAANPC1RAB9ASMN1; SMN2
SCHEMBL7119449 0.85 TP53 (0.60) TP53GAATRPV1NPC1RAB9A
SCHEMBL7763476 0.80 SMN1; SMN2 (0.64) TP53GAANPC1RAB9ASMN1; SMN2
SCHEMBL9827917 0.79 ACLY (0.60) AKR1C2AKR1C1ACLYMAPK1ALOX15
SCHEMBL7114636 0.79 SMN1; SMN2 (0.69) TP53GAANPC1RAB9ASMN1; SMN2
SCHEMBL2915657 0.78 TRPV1 (0.72) TP53GAATRPV1NPC1RAB9A
SCHEMBL7113343 0.78 KMT2A (0.52) NPC1RAB9ASMN1; SMN2ALDH1A1NFKB1
SCHEMBL7763484 0.78 MAPT (0.55) TP53GAATRPV1NPC1RAB9A
SCHEMBL7116292 0.78 P2RX1 (0.56) NPC1SMN1; SMN2LMNAMAPK1

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-20030212074-A1 Phosphate transport inhibitors SMITHKLINE BEECHAM CORPORATION 2003-11-13 — — US claimed
US-20030212074-A1 Phosphate transport inhibitors SMITHKLINE BEECHAM CORPORATION 2003-11-13 — — US disclosed
WO-2001082924-A1 PHOSPHATE TRANSPORT INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-11-08 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030212074-A1 Phosphate transport inhibitors SLC34A2, SLC34A3, SLC34A1 TP53 4292/4885GAA 420/4885TRPV1 1422/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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