SCHEMBL23927841

SCHEMBL23927841

CN(C)CCn1cc(C(=O)C(=O)N(C)C)c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.65
ALDH1A1 P00352 3/20 0.53
HTR6 P50406 6/20 0.51
CREBBP Q92793 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
CNR1 P21554 2/20 0.46
KMT2A Q03164 1/20 0.46
ADORA1 P30542 1/20 0.45
HTR2C P28335 1/20 0.45

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
SCHEMBL14199037 0.85 ALDH1A1 (0.48) CNR2ALDH1A1CREBBPSMN1; SMN2KMT2A
SCHEMBL7778088 0.85 CNR2 (0.70) CNR2ALDH1A1HTR6CREBBPSMN1; SMN2
Hydrochloric Acid SCHEMBL9354397 0.83 CNR2 (0.68) CNR2ALDH1A1HTR6CREBBPSMN1; SMN2
SCHEMBL2033409 0.82 CNR2 (0.60) CNR2ALDH1A1HTR6CREBBPCNR1
SCHEMBL9353785 0.81 NR4A2 (0.68) CNR2ALDH1A1SMN1; SMN2CNR1KMT2A
SCHEMBL3242026 0.80 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2KMT2A
SCHEMBL2077848 0.79 CNR2 (1.00) CNR2CNR1
SCHEMBL13013345 0.77 CNR2 (0.54) CNR2ALDH1A1SMN1; SMN2CNR1KMT2A
SCHEMBL6867354 0.75 CNR2 (0.58) CNR2HTR6SMN1; SMN2CNR1KMT2A
Hydrochloric Acid SCHEMBL8692389 0.75 CNR2 (0.58) CNR2ALDH1A1HTR6CREBBPCNR1

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 5 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-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
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 CNR2 17/4885ALDH1A1 1164/4885HTR6 10/4885
US-20220251040-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C CNR2 17/4885ALDH1A1 1164/4885HTR6 10/4885
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C CNR2 17/4885ALDH1A1 1164/4885HTR6 10/4885

“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.