SCHEMBL26911773

SCHEMBL26911773

c1ccc2c(C3CCN(c4ccc(N5CCOCC5)cc4)C3)c[nH]c2c1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.68
▸ KDM4E B2RXH2 3/20 0.59
▸ ATM Q13315 1/20 0.59
▸ MAPT P10636 2/20 0.51
▸ THRB P10828 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.49
▸ BRD4 O60885 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ CREBBP Q92793 1/20 0.49
▸ HTR2C P28335 2/20 0.48
▸ ADRB2 P07550 1/20 0.48
▸ HSD11B1 P28845 1/20 0.47
▸ ADRA1D P25100 3/20 0.47
▸ PRKDC P78527 1/20 0.47

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
SCHEMBL26912090 0.94 CYP2D6 (0.65) CYP2D6KDM4EATMMAPTTHRB
SCHEMBL26913055 0.86 CYP2D6 (0.60) CYP2D6KDM4EATMMAPTTHRB
SCHEMBL24331243 0.83 CYP2D6 (0.52) CYP2D6KDM4EATMALDH1A1BRD4
SCHEMBL30611141 0.83 CYP2D6 (0.52) CYP2D6KDM4EATMALDH1A1BRD4
SCHEMBL24330427 0.78 CYP2D6 (0.48) CYP2D6KDM4EATMMAPTTHRB
SCHEMBL24331227 0.78 CYP2D6 (0.48) CYP2D6KDM4EATMMAPTTHRB
SCHEMBL30611150 0.78 CYP2D6 (0.48) CYP2D6KDM4EATMMAPTTHRB
SCHEMBL26912244 0.77 CYP2D6 (0.46) CYP2D6KDM4EMAPTTHRBPRKDC
SCHEMBL26912033 0.77 PRKDC (0.60) HSD11B1PRKDC
SCHEMBL26911815 0.77 LRRK2 (0.50) CYP2D6KDM4EMAPTTHRBALDH1A1

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-20230391774-A1 Novel Compounds AC IMMUNE SA (CH) 2023-12-07 — — 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-20230391774-A1 Novel Compounds MAPT, PSEN2, PSEN1 CYP2D6 4869/4885KDM4E 4326/4885ATM 733/4885

“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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