SCHEMBL30556697

SCHEMBL30556697

Clc1ccnc(N2CC3CC3C2)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.46
▸ ACACB O00763 1/20 0.43
▸ CHI3L1 P36222 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ CHIT1 Q13231 1/20 0.39
▸ CHIA Q9BZP6 1/20 0.39
▸ DPP4 P27487 1/20 0.39
▸ GRM5 P41594 2/20 0.38
▸ HTR7 P34969 1/20 0.37
▸ KMT2A Q03164 2/20 0.36
▸ MAP3K12 Q12852 1/20 0.36
▸ TRPA1 O75762 2/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ PROKR1 Q8TCW9 1/20 0.35

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
SCHEMBL30556648 0.79 GRIN2B (0.49) CHI3L1KCNH2CHIAKMT2APROKR1
SCHEMBL2725997 0.78 TDP1 (0.58) ACACBCHI3L1KCNH2CHIT1CHIA
SCHEMBL4550904 0.78 TDP1 (0.58) ACACBCHI3L1KCNH2CHIT1CHIA
SCHEMBL2726000 0.78 TDP1 (0.58) ACACBCHI3L1KCNH2CHIT1CHIA
SCHEMBL22210091 0.76 ACACB (0.41) ATMACACBCHI3L1KCNH2CHIT1
SCHEMBL22194619 0.76 ATM (0.44) ATMACACBCHI3L1KCNH2CHIT1
SCHEMBL29539849 0.76 ATM (0.44) ATMACACBCHI3L1KCNH2CHIT1
SCHEMBL22194434 0.76 ATM (0.44) ATMACACBCHI3L1KCNH2CHIT1
SCHEMBL22194620 0.76 ATM (0.44) ATMACACBCHI3L1KCNH2CHIT1
SCHEMBL28725141 0.76 ATM (0.44) ATMACACBCHI3L1KCNH2CHIT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479827-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2025-11-25 — — US disclosed
US-20240076286-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2024-03-07 — — US disclosed
US-20240002363-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2024-01-04 — — US disclosed
US-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-09-19 — — 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 (4 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-12479827-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors KLKB1, KLK5, KLK1 ATM 2341/4885ACACB 1087/4885CHI3L1 435/4885
US-11760745-B2 Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors KLKB1, KLK5, KLK1 ATM 2341/4885ACACB 1087/4885CHI3L1 435/4885
US-20240002363-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 ATM 2341/4885ACACB 1087/4885CHI3L1 435/4885
US-20240076286-A1 HETEROAROMATIC CARBOXAMIDE DERIVATIVES AS PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 ATM 2341/4885ACACB 1087/4885CHI3L1 435/4885

“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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