SCHEMBL6029925

SCHEMBL6029925

O=C(Nc1ccccc1O)c1ccc(C(=O)Nc2ccccc2O)cc1

nearest known ligand 0.82

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.82
▸ TP53 P04637 3/20 0.82
▸ MEN1 O00255 3/20 0.82
▸ KMT2A Q03164 3/20 0.82
▸ RAB9A P51151 3/20 0.82
▸ LMNA P02545 1/20 0.68
▸ GAA P10253 1/20 0.68
▸ HTT P42858 1/20 0.68
▸ TOP1 P11387 2/20 0.63
▸ TERT O14746 1/20 0.63
▸ TOP2A P11388 1/20 0.60
▸ TOP2B Q02880 1/20 0.60
▸ POLB P06746 1/20 0.59
▸ HDAC1 Q13547 2/20 0.59
▸ METAP2 P50579 1/20 0.58
▸ F10 P00742 1/20 0.56
▸ KCNMA1 Q12791 2/20 0.56
▸ HDAC2 Q92769 1/20 0.56
▸ MDM4 O15151 1/20 0.55

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
SCHEMBL3661213 0.94 NPC1 (0.74) NPC1TP53MEN1KMT2ARAB9A
SCHEMBL1470784 0.94 NPC1 (0.73) NPC1TP53MEN1KMT2ARAB9A
SCHEMBL4946074 0.94 NPC1 (0.73) NPC1TP53MEN1KMT2ARAB9A
SCHEMBL308111 0.92 NPC1 (0.72) NPC1TP53MEN1KMT2ARAB9A
SCHEMBL16404286 0.91 NPC1 (0.70) NPC1TP53MEN1KMT2ARAB9A
SCHEMBL30608697 0.91 NPC1 (0.70) NPC1TP53MEN1KMT2ARAB9A
SCHEMBL651227 0.91 NPC1 (0.70) NPC1TP53MEN1KMT2ARAB9A
SCHEMBL11523681 0.91 NPC1 (1.00) NPC1TP53MEN1KMT2ARAB9A
SCHEMBL16335223 0.91 MEN1 (0.79) NPC1TP53MEN1KMT2ARAB9A
SCHEMBL12431980 0.89 NPC1 (0.68) NPC1TP53MEN1KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109376-B2 Benzene and naphthylene derivatives and their use as UV screening agents DSM IP ASSETS B.V. (NL) 2006-09-19 — — US disclosed
US-20060153784-A1 Novel 2-benzoxazolyl benzene derivatives and their use as UV screening agents HUBER ULRICH 2006-07-13 — — US disclosed
US-7019020-B2 2-benzoxazolyl benzene derivatives and their use as UV screening agents DSM IP ASSETS B.V. (NL) 2006-03-28 — — US disclosed
US-20040071640-A1 Novel-2-benzoxazolyl benzene derivatives and their use as uv screening agents DSM IP ASSETS B.V. (NL) 2004-04-15 — — US disclosed
EP-1358167-A1 NOVEL 2-BENZOXAZOLYL BENZENE DERIVATIVES AND THEIR USE AS UV SCREENING AGENTS Roche Vitamins AG (CH) 2003-11-05 — — EP disclosed
WO-2002062771-A1 NOVEL 2-BENZOXAZOLYL BENZENE DERIVATIVES AND THEIR USE AS UV SCREENING AGENTS ROCHE VITAMINS AG (CH) 2002-08-15 — — WO disclosed
WO-1994025501-A1 EPOXY RESINS CONTAINING THIADIAZOLE AND/OR OXADIAZOLE MOIETIES THE DOW CHEMICAL COMPANY (US) 1994-11-10 — — 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 (2 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-20040071640-A1 Novel-2-benzoxazolyl benzene derivatives and their use as uv screening agents CBX8, XRCC5, CYP8B1 NPC1 2743/4885TP53 1265/4885MEN1 4826/4885
US-20060153784-A1 Novel 2-benzoxazolyl benzene derivatives and their use as UV screening agents POLR1C, CBR3, CBR1 NPC1 2800/4885TP53 521/4885MEN1 4490/4885

“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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