SCHEMBL18766926

SCHEMBL18766926

C[C@@H](NC(O)c1cc2cc(Cl)cc(F)c2[nH]1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 2/20 0.36
▸ HRH4 Q9H3N8 5/20 0.35
▸ PYGM P11217 1/20 0.35
▸ GPR139 Q6DWJ6 2/20 0.35
▸ IDH1 O75874 1/20 0.34
▸ SLC6A4 P31645 2/20 0.34
▸ MAP2 P11137 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CRHBP P24387 1/20 0.32

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
SCHEMBL20826030 0.85 DAO (0.40) HRH4MEN1KMT2A
SCHEMBL20826032 0.85 DAO (0.40) HRH4MEN1KMT2A
SCHEMBL18766930 0.79 HRH4 (0.44) PYGLHRH4IDH1MEN1KMT2A
SCHEMBL20825908 0.77 IDH1 (0.39) HRH4IDH1MAP2
SCHEMBL17149702 0.75 PYGL (0.50) PYGLHRH4PYGMGPR139MEN1
SCHEMBL20826217 0.72 KDM4E (0.40) HRH4MEN1KMT2AALDH1A1
SCHEMBL22751757 0.72 KIF11 (0.38) SLC6A4CYP3A4CYP2D6SLC6A2SLC6A3
SCHEMBL18766990 0.72 KDM4E (0.40) HRH4MEN1KMT2AALDH1A1
SCHEMBL20826218 0.70 MLKL (0.39) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL18812226 0.68 PDE2A (0.36) GPR139CYP3A4KMT2ASMN1; SMN2LMNA

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-10167257-B2 Indole derivatives for use in medicine IOMET PHARMA LTD. (GB) 2019-01-01 — — US disclosed
US-20170107178-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IOMET PHARMA LTD. (GB) 2017-04-20 — — 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-10167257-B2 Indole derivatives for use in medicine IDO1, IDO2, TDO2 PYGL 63/4885HRH4 67/4885PYGM 574/4885
US-20170107178-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IDO1, IDO2, TDO2 PYGL 63/4885HRH4 67/4885PYGM 574/4885

“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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