SCHEMBL23320696

SCHEMBL23320696

O=C(O)CNc1ncc(Br)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
HDAC3 O15379 8/20 0.40
HDAC1 Q13547 8/20 0.40
HDAC2 Q92769 8/20 0.40
HDAC6 Q9UBN7 8/20 0.40
TSHR P16473 1/20 0.40
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
VNN1 O95497 1/20 0.38
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
EGFR P00533 2/20 0.36
MMP2 P08253 1/20 0.36
MMP7 P09237 1/20 0.36
MMP10 P09238 1/20 0.36
MMP9 P14780 1/20 0.36

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
SCHEMBL2559631 0.78 VNN1 (0.37) RAB9AHDAC3HDAC1HDAC2HDAC6
SCHEMBL12412659 0.77 SMN1; SMN2 (0.43) HDAC3HDAC1HDAC2HDAC6ALDH1A1
SCHEMBL12503461 0.77 EGLN1 (0.40) RAB9ANPC1HDAC3HDAC1HDAC2
SCHEMBL2401111 0.77 ALDH1A1 (0.52) RAB9ANPC1KDM4EALDH1A1CA12
SCHEMBL23321251 0.76 TSHR (0.59) RAB9ANPC1TSHRKDM4EALDH1A1
SCHEMBL18990622 0.76 HDAC3 (0.41) RAB9ANPC1HDAC3HDAC1HDAC2
SCHEMBL23810655 0.74 NPC1 (0.38) RAB9ANPC1KDM4EALDH1A1
SCHEMBL20876682 0.73 HDAC3 (0.39) RAB9ANPC1HDAC3HDAC1HDAC2
SCHEMBL29268482 0.73 MAPT (0.42) RAB9ANPC1TSHRKDM4EALDH1A1
SCHEMBL15635468 0.72 ALDH1A1 (0.42) RAB9ANPC1HDAC6TSHRKDM4E

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-11542273-B2 Amide compound having bet proteolysis-inducing action and medicinal application thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-01-03 US disclosed
US-20210284654-A1 AMIDE COMPOUND HAVING BET PROTEOLYSIS-INDUCING ACTION AND MEDICINAL APPLICATION THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2021-09-16 US disclosed
EP-3819305-A1 AMIDE COMPOUND HAVING BET PROTEOLYSIS-INDUCING ACTION AND MEDICINAL APPLICATION THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2021-05-12 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-11542273-B2 Amide compound having bet proteolysis-inducing action and medicinal application thereof BET1, BRD4, PHKB RAB9A 2761/4885NPC1 3288/4885HDAC3 28/4885
US-20210284654-A1 AMIDE COMPOUND HAVING BET PROTEOLYSIS-INDUCING ACTION AND MEDICINAL APPLICATION THEREOF BET1, BRD4, PHKB RAB9A 2750/4885NPC1 3072/4885HDAC3 28/4885

“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.