SCHEMBL23927825

SCHEMBL23927825

CC(Cn1cnc2ccccc21)N(C)C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APAF1 O14727 1/20 0.60
▸ TDP1 Q9NUW8 1/20 0.56
▸ AGER Q15109 5/20 0.54
▸ GGPS1 O95749 1/20 0.54
▸ FDPS P14324 1/20 0.54
▸ MAPT P10636 2/20 0.52
▸ MAPK1 P28482 2/20 0.52
▸ POLB P06746 2/20 0.52
▸ TSHR P16473 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ CYP11B1 P15538 4/20 0.50
▸ CYP11B2 P19099 4/20 0.50
▸ LMNA P02545 4/20 0.50
▸ HTT P42858 4/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ TNF P01375 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ IDO1 P14902 1/20 0.49
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 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
SCHEMBL23927823 1.00 APAF1 (0.60) APAF1TDP1AGERGGPS1FDPS
SCHEMBL1026002 0.83 APAF1 (0.67) APAF1TDP1AGERGGPS1FDPS
SCHEMBL19432570 0.81 APAF1 (0.65) APAF1TDP1AGERGGPS1FDPS
SCHEMBL14408911 0.80 APAF1 (0.63) APAF1TDP1AGERGGPS1FDPS
SCHEMBL6176569 0.80 APAF1 (0.68) APAF1TDP1AGERGGPS1FDPS
SCHEMBL6175278 0.80 APAF1 (0.68) APAF1TDP1AGERGGPS1FDPS
SCHEMBL13545635 0.79 APAF1 (0.61) APAF1TDP1AGERGGPS1FDPS
SCHEMBL11200794 0.77 APAF1 (0.60) APAF1TDP1AGERGGPS1FDPS
SCHEMBL6791275 0.76 GGPS1 (0.64) APAF1TDP1AGERGGPS1FDPS
SCHEMBL31748263 0.76 TDP1 (0.63) APAF1TDP1AGERGGPS1FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220251040-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-08-11 — — US disclosed
US-11254640-B2 N-substituted indoles and other heterocycles for treating brain disorders THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-02-22 — — US disclosed
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA CORPORATION 2021-10-28 — — 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 (3 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-11254640-B2 N-substituted indoles and other heterocycles for treating brain disorders TPH2, AANAT, HTR2C APAF1 4266/4885TDP1 2035/4885AGER 4242/4885
US-20220251040-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C APAF1 4266/4885TDP1 2035/4885AGER 4242/4885
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C APAF1 4266/4885TDP1 2035/4885AGER 4242/4885

“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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