SCHEMBL24846069

SCHEMBL24846069

CC(C)C(=O)Nc1nnc(Cc2cccc(F)c2)s1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.67
▸ GLS O94925 4/20 0.57
▸ KMT2A Q03164 4/20 0.56
▸ MEN1 O00255 3/20 0.56
▸ TSHR P16473 2/20 0.56
▸ DGAT1 O75907 1/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ POLB P06746 1/20 0.51
▸ KDM4E B2RXH2 2/20 0.51

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
SCHEMBL24846063 0.88 TSHR (0.61) RAB9AGLSKMT2AMEN1TSHR
SCHEMBL24846070 0.85 TSHR (0.61) KMT2AMEN1TSHRSMN1; SMN2POLB
SCHEMBL24846080 0.84 TSHR (0.57) RAB9AKMT2AMEN1TSHRNPC1
SCHEMBL24846085 0.82 TSHR (0.57) RAB9AKMT2AMEN1TSHRNPC1
SCHEMBL24846549 0.81 RAB9A (0.60) RAB9AGLSKMT2AMEN1TSHR
SCHEMBL24952911 0.80 RAB9A (0.52) RAB9AGLSKMT2AMEN1DGAT1
SCHEMBL29846147 0.80 RAB9A (0.52) RAB9AGLSKMT2AMEN1DGAT1
SCHEMBL24846114 0.80 KMT2A (0.48) RAB9AGLSKMT2AMEN1TSHR
SCHEMBL29047592 0.79 GLS (0.60) RAB9AGLSKMT2AMEN1TSHR
SCHEMBL24846086 0.76 KMT2A (0.48) RAB9AGLSKMT2AMEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002336-A1 MrgprX2 Antagonists and Uses Thereof DERMIRA, INC. 2023-01-05 — — US disclosed
CN-114728919-A MrgprX2 antagonists and uses thereof 德米拉公司 2022-07-08 — — CN 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-20230002336-A1 MrgprX2 Antagonists and Uses Thereof MRGPRX2, MRGPRX1, MRGPRX4 RAB9A 2006/4885GLS 1237/4885KMT2A 3840/4885

“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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