SCHEMBL20406268

SCHEMBL20406268

COc1ncccc1-c1cccnc1Oc1ccc(C=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.55
▸ ALDH1A1 P00352 3/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ LMNA P02545 1/20 0.55
▸ PDE10A Q9Y233 6/20 0.49
▸ CYP2A6 P11509 1/20 0.47
▸ BTK Q06187 1/20 0.47
▸ POLB P06746 1/20 0.42
▸ CASP6 P55212 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL20394210 0.85 PDE10A (0.56) KDM4EALDH1A1SMN1; SMN2LMNAPDE10A
SCHEMBL20406776 0.81 KMT2A (0.56) KDM4EALDH1A1PDE10ABTKPOLB
SCHEMBL20406368 0.81 PDE10A (0.46) KDM4EPDE10ABTK
SCHEMBL20406242 0.80 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2LMNACYP2A6
SCHEMBL20406392 0.79 KDM4E (0.46) KDM4EALDH1A1SMN1; SMN2LMNAPDE10A
SCHEMBL20754916 0.78 PDE10A (0.49) PDE10ABTK
SCHEMBL20394162 0.78 PDE10A (0.49) ALDH1A1PDE10ABTKTDP1
SCHEMBL20394208 0.78 PDE10A (0.49) PDE10A
SCHEMBL367302 0.77 BTK (0.45) ALDH1A1BTKPOLB
SCHEMBL20406269 0.77 ALDH1A1 (0.60) KDM4EALDH1A1SMN1; SMN2LMNAPDE10A

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 KDM4E 2642/4885ALDH1A1 2994/4885SMN1; SMN2 4801/4885
US-20190055199-A1 BIARYL DERIVATIVE AND MEDICINE CONTAINING SAME MAN2B1, CBR3, MANBA KDM4E 2642/4885ALDH1A1 2994/4885SMN1; SMN2 4801/4885

“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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