SCHEMBL26348272

SCHEMBL26348272

Nc1nc(N2CCC(NCc3ccccc3)CC2)cc(C(F)(F)F)n1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 9/20 0.52
BCHE P06276 5/20 0.48
ACHE P22303 5/20 0.48
BACE1 P56817 5/20 0.48
PIK3CB P42338 1/20 0.47
GRIN2B Q13224 1/20 0.44
CCR3 P51677 1/20 0.43
KDM4E B2RXH2 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL26346365 0.87 HDAC1 (0.45) HRH4
SCHEMBL29442400 0.87 HDAC1 (0.45) HRH4
SCHEMBL26348201 0.83 HRH4 (0.55) HRH4BCHEACHEBACE1PIK3CB
SCHEMBL26346156 0.83 MEN1 (0.58) HRH4BCHEACHEBACE1PIK3CB
SCHEMBL26348556 0.76 HRH4 (0.55) HRH4BCHEACHEBACE1GRIN2B
SCHEMBL20692326 0.73 HRH4 (0.56) HRH4BCHEACHEBACE1
SCHEMBL26346219 0.72 HRH4 (0.50) HRH4ACHEBACE1
SCHEMBL28897648 0.72 HRH4 (0.57) HRH4KDM4EHSD17B10
SCHEMBL30544999 0.72 HRH4 (0.57) HRH4KDM4EHSD17B10
Aniline SCHEMBL27970651 0.72 HRH4 (0.62) HRH4

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-20230303512-A1 MODULATORS OF MYB-MEDIATED TRANSCRIPTION AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-09-28 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 (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-20230303512-A1 MODULATORS OF MYB-MEDIATED TRANSCRIPTION AND USES THEREOF MYB, MYBBP1A, MYCBP HRH4 4801/4885BCHE 4519/4885ACHE 4510/4885

“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.