SCHEMBL20559686

SCHEMBL20559686

O=C(O)c1sc2cc(F)ccc2c1F

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCKDK O14874 2/20 0.71
▸ MCL1 Q07820 2/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ BCL2L1 Q07817 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ SENP1 Q9P0U3 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ TLR3 O15455 1/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ ESR1 P03372 2/20 0.41
▸ RPA1 P27694 1/20 0.41
▸ GPR35 Q9HC97 1/20 0.41
▸ G6PD P11413 1/20 0.41
▸ MPI P34949 1/20 0.41

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
SCHEMBL594468 0.83 BCKDK (1.00) BCKDKMCL1RXFP1RAB9ABCL2L1
SCHEMBL16693177 0.83 BCKDK (0.50) BCKDKMCL1RXFP1RAB9ABCL2L1
SCHEMBL7728937 0.83 MCL1 (0.67) BCKDKMCL1RXFP1RAB9ABCL2L1
SCHEMBL2960466 0.83 BCKDK (0.67) BCKDKMCL1RXFP1RAB9ABCL2L1
SCHEMBL2895162 0.83 BCKDK (0.67) BCKDKMCL1RXFP1RAB9ABCL2L1
SCHEMBL25257010 0.81 BCKDK (0.60) BCKDKMCL1RXFP1RAB9ABCL2L1
SCHEMBL16573127 0.80 BCKDK (0.48) BCKDKMCL1RXFP1RAB9ABCL2L1
SCHEMBL121465 0.80 BCKDK (0.48) BCKDKMCL1RXFP1BCL2L1ALDH1A1
SCHEMBL25217782 0.79 BCKDK (0.61) BCKDKMCL1RXFP1RAB9AALDH1A1
SCHEMBL25203600 0.79 BCKDK (0.61) BCKDKMCL1RXFP1RAB9ABCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11420944-B2 Voltage-dependent t-type calcium channel blocker NIPPON CHEMIPHAR CO., LTD. (JP) 2022-08-23 — — US disclosed
US-20190077767-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL BLOCKER NIPPON CHEMIPHAR CO., LTD. (JP) 2019-03-14 — — US disclosed
EP-3404021-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL INHIBITOR Nippon Chemiphar Co., Ltd. (JP) 2018-11-21 — — 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 (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-11420944-B2 Voltage-dependent t-type calcium channel blocker CACNA1I, CACNA1G, CACNA1E BCKDK 715/4885MCL1 3264/4885RXFP1 2095/4885
US-20190077767-A1 VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL BLOCKER CACNA1I, CACNA1G, CACNA1E BCKDK 1046/4885MCL1 3067/4885RXFP1 1989/4885

“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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