SCHEMBL2443894

SCHEMBL2443894

O=C(O)Cc1cc(F)ccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 2/20 0.55
▸ TSHR P16473 3/20 0.51
▸ EGFR P00533 2/20 0.49
▸ GAA P10253 2/20 0.47
▸ NFKB1 P19838 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ HIF1A Q16665 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ RGS12 O14924 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ APEX1 P27695 1/20 0.47
▸ THPO P40225 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ GNAI1 P63096 1/20 0.47
▸ PMP22 Q01453 1/20 0.47
▸ AGBL2 Q5U5Z8 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
SCHEMBL2395772 0.88 TSHR (0.54) AKR1B1TSHRGAANFKB1TDP1
SCHEMBL11023467 0.85 MMP1 (0.49) AKR1B1TSHREGFRGAANFKB1
SCHEMBL10707197 0.83 AKR1B1 (0.46) AKR1B1TSHREGFRGAANFKB1
SCHEMBL10603384 0.82 POLB (0.51) POLB
SCHEMBL25782332 0.82 ANO1 (0.45) GAAPOLBKDM4ELMNAHIF1A
SCHEMBL29471363 0.82 TSHR (0.53) AKR1B1TSHRHSD17B10AGBL2CXCL8
SCHEMBL503667 0.82 TSHR (0.53) AKR1B1TSHRHSD17B10AGBL2CXCL8
SCHEMBL502877 0.80 AKR1B1 (0.58) AKR1B1TSHREGFRGAANFKB1
SCHEMBL27884951 0.79 ANO1 (0.43) KDM4ELMNAHIF1AHSD17B10MAPT
SCHEMBL17011669 0.79 F13A1 (0.46) POLBLMNAMEN1KMT2A

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3939658-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2022-01-19 — — EP disclosed
CN-110753693-A EGFR proteolytic targeting chimeric molecules and related methods of use 阿尔维纳斯运营股份有限公司 2020-02-04 — — CN disclosed
CN-109475528-A Bifunctional molecules for EGFR degradation and methods of use 达纳-法伯癌症研究所股份有限公司 2019-03-15 — — CN disclosed
EP-1997811-B1 Indazole, benzoxazole and pyrazolopyridine derivatives as P38 kinase inhibitors ARRAY BIOPHARMA INC (US) 2015-04-08 — — EP disclosed
CN-101759645-B P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC 2014-06-25 — — CN disclosed
EP-1997809-B1 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC (US) 2014-05-14 — — EP disclosed
US-8518983-B2 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2013-08-27 — — US disclosed
US-8518983-B2 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2013-08-27 — — US disclosed
EP-1997810-B1 Indazoles, benzotriazoles and N-analogs thereof as p38 kinase inhibitors ARRAY BIOPHARMA INC (US) 2013-07-31 — — EP disclosed
EP-1997810-B1 Indazoles, benzotriazoles and N-analogs thereof as p38 kinase inhibitors ARRAY BIOPHARMA INC (US) 2013-07-31 — — EP disclosed
EP-1997809-A2 Indazole, benzoxazole and pyrazolopyridine derivatives for medical use Array Biopharma Inc. (US) 2008-12-03 — — EP disclosed
EP-1997810-A2 Indazole, benzoxazole and pyrazolopyridine derivatives for medical use Array Biopharma Inc. (US) 2008-12-03 — — EP disclosed
EP-1997810-A2 Indazole, benzoxazole and pyrazolopyridine derivatives for medical use Array Biopharma Inc. (US) 2008-12-03 — — EP disclosed
WO-2004078116-A9 P38 INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC (US) 2008-09-12 — — WO disclosed
EP-1606283-A4 P38 INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC (US) 2007-05-23 — — EP disclosed
CN-1784396-A p38 inhibitors and methods of their use ARRAY BIOPHARMA INC (US) 2006-06-07 — — CN disclosed
EP-1606283-A2 P38 INHIBITORS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2005-12-21 — — EP disclosed
US-20040192653-A1 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC. 2004-09-30 — — US disclosed
US-20040180896-A1 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA, INC. 2004-09-16 — — US disclosed
WO-2004078116-A2 P38 INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA, INC. (US) 2004-09-16 — — 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-20040180896-A1 P38 inhibitors and methods of use thereof MAPK1, MAPK3, MAPK8 AKR1B1 1350/4885TSHR 3869/4885EGFR 2342/4885
US-20040192653-A1 P38 inhibitors and methods of use thereof MAPK1, MAPK3, MAPK8 AKR1B1 1350/4885TSHR 3869/4885EGFR 2342/4885

“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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