SCHEMBL18444056

SCHEMBL18444056

Nc1ccc(Cl)c(F)c1C=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ TSHR P16473 5/20 0.34
▸ CYP3A4 P08684 3/20 0.34
▸ CA12 O43570 3/20 0.34
▸ CA1 P00915 3/20 0.34
▸ CA2 P00918 3/20 0.34
▸ CA7 P43166 3/20 0.34
▸ CA9 Q16790 3/20 0.34
▸ CA14 Q9ULX7 3/20 0.34
▸ CA4 P22748 2/20 0.34
▸ CA6 P23280 2/20 0.34
▸ CA5A P35218 2/20 0.34
▸ CA5B Q9Y2D0 2/20 0.34
▸ THRB P10828 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ CASP1 P29466 1/20 0.34

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
SCHEMBL14690948 0.82 ALDH1A1 (0.54) ALDH1A1MEN1KMT2ATDP1HPGD
SCHEMBL29447959 0.78 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ATDP1CYP3A4
SCHEMBL615646 0.78 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ATDP1CYP3A4
SCHEMBL9005985 0.78 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ATDP1TSHR
SCHEMBL19126540 0.78 CA12 (0.36) ALDH1A1MEN1KMT2ATDP1CYP3A4
SCHEMBL1814731 0.77 TDP1 (0.43) ALDH1A1MEN1KMT2ATDP1THRB
SCHEMBL23088387 0.75 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ATDP1TSHR
SCHEMBL14691491 0.75 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ATDP1TSHR
SCHEMBL1016906 0.75 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ATDP1
SCHEMBL275539 0.75 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ATDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12221441-B2 Plasma kallikrein inhibitors and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-02-11 — — US disclosed
EP-4477220-A2 PLASMA KALLIKREIN INHIBITORS AND USES THEREOF Takeda Pharmaceutical Company Limited (JP) 2024-12-18 — — EP disclosed
EP-4031547-B1 PLASMA KALLIKREIN INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2024-07-17 — — EP disclosed
EP-4031547-B1 PLASMA KALLIKREIN INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2024-07-17 — — EP disclosed
CN-117480164-B Factor XIa inhibitor and preparation method and application thereof 上海领泰生物医药科技有限公司 2024-07-05 — — CN disclosed
CN-117480164-A Factor XIa inhibitor and preparation method and application thereof 上海领泰生物医药科技有限公司 2024-01-30 — — CN disclosed
US-20230391773-A1 PLASMA KALLIKREIN INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-12-07 — — US disclosed
US-11787796-B2 Plasma Kallikrein inhibitors and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-17 — — US disclosed
US-11787796-B2 Plasma Kallikrein inhibitors and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-17 — — US disclosed
US-11787796-B2 Plasma Kallikrein inhibitors and uses thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-17 — — US disclosed
EP-3331872-B1 NOVEL SUBSTITUTED GLYCINE DERIVED FXIA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-09-25 — — EP disclosed
EP-3331872-B1 NOVEL SUBSTITUTED GLYCINE DERIVED FXIA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-09-25 — — EP disclosed
US-10336730-B2 Substituted glycine derived FXIA inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-07-02 — — US disclosed
US-10336730-B2 Substituted glycine derived FXIA inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-07-02 — — US disclosed
US-20180222889-A1 NOVEL SUBSTITUTED GLYCINE DERIVED FXIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-08-09 — — US disclosed
US-20180222889-A1 NOVEL SUBSTITUTED GLYCINE DERIVED FXIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-08-09 — — US disclosed
US-20180222889-A1 NOVEL SUBSTITUTED GLYCINE DERIVED FXIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-08-09 — — US disclosed
EP-3331872-A1 NOVEL SUBSTITUTED GLYCINE DERIVED FXIA INHIBITORS Bristol-Myers Squibb Company (US) 2018-06-13 — — EP disclosed
WO-2017023992-A1 NOVEL SUBSTITUTED GLYCINE DERIVED FXIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2017-02-09 — — WO disclosed
WO-2017023992-A1 NOVEL SUBSTITUTED GLYCINE DERIVED FXIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2017-02-09 — — 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 (5 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-12221441-B2 Plasma kallikrein inhibitors and uses thereof KLKB1, KLK1, KLK5 ALDH1A1 3007/4885MEN1 633/4885KMT2A 1299/4885
US-11787796-B2 Plasma Kallikrein inhibitors and uses thereof KLKB1, KLK1, KLK5 ALDH1A1 3007/4885MEN1 633/4885KMT2A 1299/4885
US-10336730-B2 Substituted glycine derived FXIA inhibitors F2, TFPI, TFPI2 ALDH1A1 4317/4885MEN1 882/4885KMT2A 943/4885
US-20180222889-A1 NOVEL SUBSTITUTED GLYCINE DERIVED FXIA INHIBITORS TFPI, TFPI2, F2 ALDH1A1 4409/4885MEN1 1086/4885KMT2A 1073/4885
US-20230391773-A1 PLASMA KALLIKREIN INHIBITORS AND USES THEREOF KLKB1, KLK1, KLK5 ALDH1A1 3007/4885MEN1 633/4885KMT2A 1299/4885

“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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