SCHEMBL19619720

SCHEMBL19619720

CSc1ccc(C(N)C(N)c2cccc(C)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.44
MAOA P21397 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
DPP4 P27487 2/20 0.39
ACHE P22303 1/20 0.37
AOC3 Q16853 1/20 0.36
ACP3 P15309 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.32
AKR1C3 P42330 2/20 0.32
AKR1C2 P52895 2/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 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
SCHEMBL3259002 0.83 ACHE (0.52) DPP4ACHEAOC3ACP3ALDH1A1
SCHEMBL3254719 0.83 ACHE (0.52) DPP4ACHEAOC3ACP3ALDH1A1
SCHEMBL12569050 0.83 ACHE (0.52) DPP4ACHEAOC3ACP3ALDH1A1
SCHEMBL19619722 0.81 SLC6A4 (0.43) SLC6A4MAOASLC6A2SLC6A3DPP4
SCHEMBL17519154 0.79 ADRB2 (0.45) SLC6A4SLC6A2SLC6A3DPP4ACHE
SCHEMBL17519158 0.75 CASR (0.41) DPP4ACHEAOC3ACP3HTT
SCHEMBL11475525 0.74 ROCK1 (0.40) SLC6A4ACHEAOC3ACP3ALDH1A1
SCHEMBL23241790 0.74 AOC3 (0.46) DPP4ACHEAOC3ACP3ALDH1A1
SCHEMBL19998570 0.73 IDO1 (0.47) DPP4ACP3HTTKMT2A
SCHEMBL11003398 0.71 ACHE (0.52) ACHEAOC3ACP3ALDH1A1MAPT

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-10647702-B2 Aryl-substituted imidazoles ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2020-05-12 US disclosed
US-9822100-B2 Aryl-substituted imidazoles ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2017-11-21 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-10647702-B2 Aryl-substituted imidazoles MDM2, TP53, MDM4 SLC6A4 3060/4885MAOA 2382/4885SLC6A2 4334/4885

“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.