SCHEMBL18766930

SCHEMBL18766930

C[C@@H](NC(O)c1cc2cc(Cl)ccc2[nH]1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 1/20 0.44
▸ HRH3 Q9Y5N1 1/20 0.44
▸ MEN1 O00255 2/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP19A1 P11511 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ PYGL P06737 10/20 0.41
▸ IDH1 O75874 2/20 0.41
▸ F7 P08709 1/20 0.40
▸ F3 P13726 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ CRHBP P24387 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CRHR2 Q13324 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
SCHEMBL18766968 0.86 TP53 (0.43) MEN1NPC1RAB9AKMT2AMAPT
SCHEMBL20825908 0.82 IDH1 (0.39) HRH4KDM4EIDH1
SCHEMBL18766922 0.81 IDH1 (0.45) HRH4HRH3IDH1
SCHEMBL18766880 0.80 HRH4 (0.47) HRH4HRH3IDH1
SCHEMBL18766926 0.79 PYGL (0.36) HRH4MEN1KMT2ALMNAMAPT
SCHEMBL20826218 0.78 MLKL (0.39) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL18766993 0.77 HRH4 (0.55) HRH4HRH3KMT2A
SCHEMBL22751757 0.77 KIF11 (0.38) MEN1KMT2AKDM4E
SCHEMBL28390130 0.76 MEN1 (0.54) HRH4HRH3MEN1NPC1RAB9A
SCHEMBL17149864 0.73 PYGL (0.63) MEN1NPC1RAB9AKMT2APYGL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20170107178-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IDO1, IDO2, TDO2 HRH4 67/4885HRH3 111/4885MEN1 3708/4885

“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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