SCHEMBL30941197

SCHEMBL30941197

Nc1nc(Cl)nc2c1c(-c1nc(Cc3ccccc3)cs1)cn2[C@@H]1C[C@H](C2CCN(C[C@H]3CCOC3)CC2)[C@@H](O)[C@H]1O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 7/20 0.36
▸ KCNH2 Q12809 7/20 0.36
▸ CYP1A1 P04798 1/20 0.30
▸ CYP2C8 P10632 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ UBE2M P61081 1/20 0.30
▸ DCUN1D1 Q96GG9 1/20 0.30
▸ DRD2 P14416 1/20 0.30
▸ DRD4 P21917 1/20 0.30
▸ DRD3 P35462 1/20 0.30

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
SCHEMBL25047576 1.00 CNR1 (0.36) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL31618049 1.00 CNR1 (0.36) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL25047574 1.00 CNR1 (0.36) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL25047787 0.93 DRD2 (0.33) CNR1KCNH2DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL30941307 0.92 KCNH2 (0.32) CNR1KCNH2DRD2DRD4DRD3
SCHEMBL25047889 0.91 IGF1R (0.32) CNR1KCNH2DRD2DRD4DRD3
SCHEMBL25049346 0.90 KCNH2 (0.36) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL25047793 0.88 C1S (0.33) DRD2DRD4DRD3
SCHEMBL25048632 0.86 KCNH2 (0.34) CNR1KCNH2CYP1A1CYP2C8CYP2D6
SCHEMBL25049338 0.86 CA2 (0.32) DRD2DRD4DRD3

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-20250188110-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2025-06-12 — — 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-20250188110-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION KMT5A, KMT5B, KMT5C CNR1 2998/4885KCNH2 1642/4885CYP1A1 652/4885

“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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