SCHEMBL5266878

SCHEMBL5266878

O=c1c(-c2ccccc2F)coc2cc(O)c(Cl)cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX12 P18054 2/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ PPARG P37231 3/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ NCOA2 Q15596 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46
▸ NCOR2 Q9Y618 1/20 0.46
▸ PIK3CA P42336 1/20 0.45
▸ KDM4E B2RXH2 4/20 0.45
▸ ALDH1A1 P00352 4/20 0.45
▸ HPGD P15428 3/20 0.45
▸ HSD17B10 Q99714 3/20 0.45
▸ USP2 O75604 2/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ POLB P06746 1/20 0.44

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
SCHEMBL234545 0.87 ALOX12 (0.51) ALOX12ALOX15PPARGNPSR1LMNA
SCHEMBL14396124 0.84 KDM4E (0.65) ALOX12ALOX15PPARGNPSR1LMNA
SCHEMBL5271608 0.84 ALOX12 (0.48) ALOX12ALOX15PPARGNPSR1LMNA
SCHEMBL4175173 0.83 ALDH1A1 (0.63) ALOX12ALOX15PPARGNPSR1LMNA
SCHEMBL234246 0.81 KDM4E (0.67) ALOX15PPARGKDM4EALDH1A1HPGD
SCHEMBL5266770 0.80 RAB9A (0.64) ALOX12ALOX15PPARGNPSR1LMNA
SCHEMBL678221 0.78 ALOX15 (0.78) ALOX12ALOX15PPARGNPSR1LMNA
SCHEMBL5266781 0.78 RAB9A (0.54) ALOX12ALOX15PPARGNPSR1LMNA
SCHEMBL14396323 0.77 RAB9A (0.50) ALOX12ALOX15PPARGNPSR1LMNA
SCHEMBL19236369 0.76 ALOX12 (0.62) ALOX12ALOX15PPARGNPSR1LMNA

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
EP-1456180-B1 3-(2,4)DIHYDROXYPHENYL-4-PHENYLPYRAZOLES AND THEIR MEDICAL USE VERNALIS CAMBRIDGE LTD (GB) 2007-10-03 — — EP disclosed
EP-1456180-B1 3-(2,4)DIHYDROXYPHENYL-4-PHENYLPYRAZOLES AND THEIR MEDICAL USE VERNALIS CAMBRIDGE LTD (GB) 2007-10-03 — — EP disclosed
US-7247734-B2 3,4-diarylpyrazoles and their use in the therapy of cancer VERNALIS (CAMBRIDGE) LIMITED (GB) 2007-07-24 — — US disclosed
US-7247734-B2 3,4-diarylpyrazoles and their use in the therapy of cancer VERNALIS (CAMBRIDGE) LIMITED (GB) 2007-07-24 — — US disclosed
US-20050222230-A1 3,4-diarylpyrazoles and their use in the therapy of cancer VERNALIS (CAMBRIDGE) LIMITED (GB) 2005-10-06 — — US disclosed
EP-1456180-A1 3,4-DIARYLPYRAZOLES AND THEIR USE IN THE THERAPY OF CANCER Vernalis (Oxford) Ltd (GB) 2004-09-15 — — EP disclosed
WO-2003055860-A1 3,4-DIARYLPYRAZOLES AND THEIR USE IN THE THERAPY OF CANCER VERNALIS (CAMBRIDGE) LIMITED (GB) 2003-07-10 — — 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 (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-20050222230-A1 3,4-diarylpyrazoles and their use in the therapy of cancer HSP90AB1, HSP90AA1, HSP90AB2P ALOX12 1738/4885ALOX15 882/4885PPARG 1438/4885

“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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