SCHEMBL20406717

SCHEMBL20406717

CCCOCC(F)(F)c1ccc(Oc2ncccc2-c2ccc(F)cc2OC)cn1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 2/20 0.37
▸ MAPT P10636 2/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ GPBAR1 Q8TDU6 6/20 0.34
▸ TRPA1 O75762 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ PDE10A Q9Y233 1/20 0.34
▸ GRM5 P41594 2/20 0.33

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
SCHEMBL20394406 0.93 GPBAR1 (0.39) SYKMAPTMAPK1NPSR1KDM4E
SCHEMBL20394367 0.93 SYK (0.38) SYKMAPTMAPK1NPSR1KDM4E
SCHEMBL20742787 0.92 PDE10A (0.40) MAPTMAPK1NPSR1KDM4EPOLB
SCHEMBL18661468 0.90 SYK (0.39) SYKMAPTMAPK1NPSR1KDM4E
SCHEMBL20406480 0.86 SYK (0.37) SYKMAPTMAPK1NPSR1KDM4E
SCHEMBL20394474 0.86 SYK (0.41) SYKMAPTMAPK1NPSR1KDM4E
SCHEMBL18661511 0.85 GPBAR1 (0.41) SYKGPBAR1TRPA1CYP1A2CYP3A4
SCHEMBL20394186 0.84 SCN9A (0.36) SYKGPBAR1PDE10A
SCHEMBL18661510 0.84 SYK (0.40) SYKMAPTMAPK1NPSR1KDM4E
SCHEMBL20406290 0.83 MAPT (0.37) SYKMAPTMAPK1NPSR1KDM4E

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-10647675-B2 Biaryl derivative and medicine containing same KAKEN PHARMACEUTICAL CO., LTD. (JP) 2020-05-12 — — US disclosed
US-20190055199-A1 BIARYL DERIVATIVE AND MEDICINE CONTAINING SAME KAKEN PHARMACEUTICAL CO., LTD. (JP) 2019-02-21 — — US disclosed
EP-3351533-A1 BIARYL DERIVATIVE AND MEDICINE CONTAINING SAME Kaken Pharmaceutical Co., Ltd. (JP) 2018-07-25 — — 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-10647675-B2 Biaryl derivative and medicine containing same MAN2B1, CBR3, MANBA SYK 1394/4885MAPT 4703/4885MAPK1 2563/4885
US-20190055199-A1 BIARYL DERIVATIVE AND MEDICINE CONTAINING SAME MAN2B1, CBR3, MANBA SYK 1394/4885MAPT 4703/4885MAPK1 2563/4885

“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.

Send feedback