SCHEMBL2496417

SCHEMBL2496417

FC(F)OCOc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.46
ALOX15 P16050 1/20 0.45
MAOA P21397 1/20 0.42
PTGS1 P23219 1/20 0.42
LMNA P02545 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MTNR1A P48039 3/20 0.42
MTNR1B P49286 3/20 0.42
TAAR1 Q96RJ0 1/20 0.41
ALDH1A1 P00352 1/20 0.41
RECQL P46063 1/20 0.41
SCN4A P35499 2/20 0.41
LTA4H P09960 1/20 0.41
PKM P14618 1/20 0.39

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
SCHEMBL5702516 0.77 LMNA (0.52) KCNA3MAOAPTGS1LMNAMTNR1A
SCHEMBL497461 0.77 KCNA3 (0.63) KCNA3ALOX15LMNACYP2C9CYP2C19
SCHEMBL873385 0.77 MAOB (0.51) MAOALMNAALDH1A1
Hydrochloric Acid SCHEMBL10519295 0.75 KCNA3 (0.60) KCNA3ALOX15LMNACYP2C9CYP2C19
Ammonia Solution, Strong SCHEMBL28919640 0.75 KCNA3 (0.60) KCNA3ALOX15LMNACYP2C9CYP2C19
SCHEMBL5188457 0.75 KCNA3 (0.60) KCNA3ALOX15LMNACYP2C9CYP2C19
Hydrochloric Acid SCHEMBL10555789 0.75 KCNA3 (0.60) KCNA3ALOX15LMNACYP2C9CYP2C19
SCHEMBL7559361 0.72 MAOA (0.47) KCNA3MAOAPTGS1LMNAMTNR1A
SCHEMBL6831001 0.72 SCN4A (0.50) KCNA3ALOX15MAOAPTGS1LMNA
SCHEMBL4331326 0.72 KCNA3 (0.57) KCNA3ALOX15LMNACYP2C9CYP2C19

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-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-25 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-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle AVPR1B, AVPR1A, AVPR2 KCNA3 2476/4885ALOX15 1687/4885MAOA 637/4885

“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.