SCHEMBL2390291

SCHEMBL2390291

Cc1nnnn1-c1ccc(O)cc1F

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 2/20 0.40
▸ ESR2 Q92731 2/20 0.40
▸ KCNN4 O15554 13/20 0.38
▸ NOTUM Q6P988 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL2896712 0.81 KCNN4 (0.40) KCNN4NOTUMNPC1RAB9ALMNA
SCHEMBL2657250 0.81 KCNN4 (0.42) KCNN4NOTUMNPC1RAB9ALMNA
SCHEMBL2897051 0.80 KCNN4 (0.36) KCNN4NOTUMNPC1RAB9ALMNA
SCHEMBL19527731 0.77 NOTUM (0.38) KCNN4NOTUMNPC1RAB9ALMNA
SCHEMBL5545479 0.76 KCNN4 (0.60) KCNN4
SCHEMBL5222424 0.76 KCNN4 (0.35) KCNN4NOTUMNPC1RAB9ALMNA
SCHEMBL15337292 0.75 KCNN4 (0.36) KCNN4NOTUMLMNA
SCHEMBL15337360 0.73 NOTUM (0.43) KCNN4NOTUMLMNASMN1; SMN2
SCHEMBL13408564 0.72 L3MBTL1 (0.42) KCNN4NPC1RAB9ALMNASMN1; SMN2
SCHEMBL1486496 0.72 CA12 (0.54) ESR1ESR2LMNA

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-20110212939-A1 Heterocyclic GPCR Agonists PROSIDION LIMITED (GB) 2011-09-01 — — US disclosed
CN-102131778-A Heterocyclic gpcr agonists PROSIDION LTD 2011-07-20 — — 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-20110212939-A1 Heterocyclic GPCR Agonists GPR119, GCGR, GPR27 ESR1 419/4885ESR2 390/4885KCNN4 2021/4885

“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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