SCHEMBL25016018

SCHEMBL25016018

NCc1ccc2cc(C(=O)NCC3CCNCC3)n(-c3ccc4ccccc4c3)c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR4 Q13639 3/20 0.46
▸ EP300 Q09472 1/20 0.40
▸ CHRM1 P11229 6/20 0.40
▸ TPSAB1 Q15661 2/20 0.40
▸ HDAC3 O15379 1/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC7 Q8WUI4 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ HDAC10 Q969S8 1/20 0.38
▸ HDAC11 Q96DB2 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ HDAC9 Q9UKV0 1/20 0.38
▸ HDAC5 Q9UQL6 1/20 0.38
▸ CHRM2 P08172 2/20 0.38
▸ CHRM4 P08173 2/20 0.38
▸ CHRM3 P20309 2/20 0.38
▸ BCHE P06276 1/20 0.38
▸ MAOB P27338 1/20 0.38

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
SCHEMBL21822542 0.85 HTR4 (0.44) HTR4CHRM1TPSAB1HDAC3HDAC4
SCHEMBL28582228 0.84 HTR4 (0.45) HTR4CHRM1HDAC3HDAC4HDAC1
SCHEMBL25017427 0.79 HTR4 (0.43) HTR4EP300PPARG
SCHEMBL25016778 0.78 PRSS1 (0.46) TPSAB1
SCHEMBL21822628 0.73 F10 (0.55) —
SCHEMBL28598772 0.72 HTR4 (0.44) HTR4CHRM1BCHEPPARGACSS2
SCHEMBL25017546 0.72 F10 (0.43) HTR4HDAC3HDAC4HDAC1HDAC7
SCHEMBL21822469 0.72 F10 (0.43) HTR4HDAC3HDAC4HDAC1HDAC7
SCHEMBL21822470 0.72 F10 (0.43) HTR4HDAC3HDAC4HDAC1HDAC7
SCHEMBL10144838 0.72 HDAC3 (0.67) HTR4CHRM1HDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230043159-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF DISC MEDICINE, INC. 2023-02-09 — — US 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 (1 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-20230043159-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF MMP7, MATR3, SPINT2 HTR4 1691/4885EP300 3582/4885CHRM1 4881/4885

“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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