SCHEMBL9099249

SCHEMBL9099249

COc1cc(C(=O)N(C)[C@H](CN2CCCC(F)(F)C2)C(C)C)ccc1C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ TAS1R3 Q7RTX0 1/20 0.37
▸ TAS1R1 Q7RTX1 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ TSHR P16473 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
SCHEMBL9099255 1.00 CYP3A4 (0.38) CYP3A4USP2KMT2ATAS1R3TAS1R1
SCHEMBL9106912 0.89 ALDH1A1 (0.37) CYP3A4USP2CYP1A2CYP2D6TSHR
SCHEMBL9106904 0.89 ALDH1A1 (0.37) CYP3A4USP2CYP1A2CYP2D6TSHR
SCHEMBL9275959 0.89 CYP3A4 (0.38) CYP3A4USP2KMT2ATAS1R3TAS1R1
SCHEMBL9274756 0.84 ADORA2A (0.43) CYP3A4USP2CYP2D6TSHR
SCHEMBL9289051 0.83 CYP3A4 (0.40) CYP3A4USP2KMT2AMEN1CYP1A2
SCHEMBL9099355 0.83 HDAC4 (0.37) CYP3A4CYP1A2
SCHEMBL9099364 0.83 HDAC4 (0.37) CYP3A4CYP1A2
SCHEMBL9103958 0.81 OPRD1 (0.37) CYP3A4USP2CYP1A2CYP2D6
SCHEMBL9103967 0.81 OPRD1 (0.37) CYP3A4USP2CYP1A2CYP2D6

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
WO-2025082731-A1 INTRANASAL FORMULATIONS FOR TREATING OBSTRUCTIVE SLEEP APNEA MOSANNA THERAPEUTICS AG (CH) 2025-04-24 — — WO disclosed
US-20130143858-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS ASTRAZENECA AB (SE) 2013-06-06 — — US disclosed
US-8361998-B2 Compounds and their use as IKACh blockers ASTRAZENECA AB 2013-01-29 — — US disclosed
US-20120142659-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS ASTRAZENECA AB (SE) 2012-06-07 — — 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 (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-20130143858-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS KCNH2, KCNJ2, KCNH3 CYP3A4 1843/4885USP2 3248/4885KMT2A 552/4885
US-20120142659-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS KCNH2, KCNJ2, KCNH3 CYP3A4 1843/4885USP2 3248/4885KMT2A 552/4885

“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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