SCHEMBL2848375

SCHEMBL2848375

O=C(N[C@H]1CCC[C@@H]1O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
GAA P10253 1/20 0.57
CPB1 P15086 2/20 0.55
TSHR P16473 1/20 0.54
EPHX1 P07099 1/20 0.54
CASP3 P42574 3/20 0.54
CTSB P07858 3/20 0.52
CTSK P43235 3/20 0.52
CTSS P25774 2/20 0.52
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CTSL P07711 2/20 0.49

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
SCHEMBL5896895 1.00 ALDH1A1 (0.57) ALDH1A1GAACPB1TSHREPHX1
SCHEMBL5896898 1.00 ALDH1A1 (0.57) ALDH1A1GAACPB1TSHREPHX1
SCHEMBL5897664 1.00 ALDH1A1 (0.57) ALDH1A1GAACPB1TSHREPHX1
SCHEMBL5897658 1.00 ALDH1A1 (0.57) ALDH1A1GAACPB1TSHREPHX1
SCHEMBL31064941 1.00 ALDH1A1 (0.57) ALDH1A1GAACPB1TSHREPHX1
SCHEMBL18544232 0.97 EPHX1 (0.58) ALDH1A1GAACPB1TSHREPHX1
SCHEMBL5749471 0.97 EPHX1 (0.58) ALDH1A1GAACPB1TSHREPHX1
SCHEMBL13917140 0.97 EPHX1 (0.58) ALDH1A1GAACPB1TSHREPHX1
SCHEMBL13326281 0.97 EPHX1 (0.58) ALDH1A1GAACPB1TSHREPHX1
SCHEMBL5751554 0.97 EPHX1 (0.58) ALDH1A1GAACPB1TSHREPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11667631-B2 FGFR4 inhibitor, preparation method therefor, and applications thereof JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-06-06 US disclosed
EP-3190116-B1 PYRAZOLOTHIAZOLE COMPOUND AND MEDICINE COMPRISING SAME NIPPON SHINYAKU CO LTD (JP) 2020-08-05 EP disclosed
EP-3444250-A1 FGFR4 INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2019-02-20 EP disclosed
US-9999622-B2 Pyrazolothiazole compound and medicine comprising same NIPPON SHINYAKU CO., LTD. (JP) 2018-06-19 US disclosed
US-9937176-B2 Pyrazolothiazole compound and medicine comprising same NIPPON SHINYAKU CO., LTD. (JP) 2018-04-10 US disclosed
US-20180092919-A1 PYRAZOLOTHIAZOLE COMPOUND AND MEDICINE COMPRISING SAME NIPPON SHINYAKU CO., LTD. (JP) 2018-04-05 US disclosed
US-20170252341-A1 PYRAZOLOTHIAZOLE COMPOUND AND MEDICINE COMPRISING SAME NIPPON SHINYAKU CO., LTD. (JP) 2017-09-07 US disclosed
EP-3190116-A1 PYRAZOLOTHIAZOLE COMPOUND AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2017-07-12 EP disclosed
EP-2141147-A1 ORNITHINE DERIVATIVE Astellas Pharma Inc. (JP) 2010-01-06 EP disclosed
US-7038087-B2 Process for the production of optically active amino alcohols TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-05-02 US disclosed
US-20040063999-A1 Process for the production of optically active amino alcohols TAKASAGO INTERNATIONAL CORPORATION (JP) 2004-04-01 US disclosed
EP-1398310-A1 Process for the production of optically active amino alcohols Takasago International Corporation (JP) 2004-03-17 EP 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 (4 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-11667631-B2 FGFR4 inhibitor, preparation method therefor, and applications thereof FGFR4, FGFR1, FGFR2 ALDH1A1 855/4885GAA 2973/4885CPB1 3117/4885
US-20180092919-A1 PYRAZOLOTHIAZOLE COMPOUND AND MEDICINE COMPRISING SAME JAK1, JAK2, JAK3 ALDH1A1 1360/4885GAA 3808/4885CPB1 2269/4885
US-20170252341-A1 PYRAZOLOTHIAZOLE COMPOUND AND MEDICINE COMPRISING SAME JAK1, JAK2, JAK3 ALDH1A1 1360/4885GAA 3808/4885CPB1 2269/4885
US-20040063999-A1 Process for the production of optically active amino alcohols ADH1C, ADH1A, ADH5 ALDH1A1 22/4885GAA 3298/4885CPB1 2223/4885

“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.