SCHEMBL24774522

SCHEMBL24774522

COCCOc1ccccc1C1CCCN1C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 1/20 0.39
▸ GRM2 Q14416 1/20 0.39
▸ CHRNB4 P30926 1/20 0.39
▸ CHRNA3 P32297 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ P2RX3 P56373 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ HTR1B P28222 1/20 0.36
▸ HCRTR1 O43613 1/20 0.36
▸ HCRTR2 O43614 1/20 0.36
▸ FFAR2 O15552 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ NTRK1 P04629 1/20 0.36
▸ HTR1A P08908 1/20 0.36

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
SCHEMBL24774754 0.88 HTR2C (0.47) ALDH1A1SMN1; SMN2CYP1A2CYP2D6CYP2C19
SCHEMBL24775070 0.85 SMN1; SMN2 (0.49) HTR2AALDH1A1SMN1; SMN2HSD17B10HCRTR1
SCHEMBL24775175 0.85 SMN1; SMN2 (0.49) HTR2AALDH1A1SMN1; SMN2HSD17B10HCRTR1
SCHEMBL24775062 0.85 HTR1B (0.45) ALDH1A1SMN1; SMN2P2RX3HTR1DHTR1B
SCHEMBL24775072 0.84 HSP90AA1 (0.47) ALDH1A1
SCHEMBL24775174 0.84 HSP90AA1 (0.47) ALDH1A1
SCHEMBL24774523 0.79 HSP90AA1 (0.36) CHRNB4CHRNA3ALDH1A1SMN1; SMN2
SCHEMBL24775361 0.77 ADRA1A (0.43) CHRNB4CHRNA3P2RX3
SCHEMBL24774521 0.77 CHRNA7 (0.44) CHRNB4CHRNA3ALDH1A1HCRTR1HCRTR2
SCHEMBL24774520 0.77 HCRTR2 (0.46) HTR2AHCRTR1HCRTR2

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-20230002369-A1 Bcl-2 INHIBITORS BEONE MEDICINES I GMBH (CH) 2023-01-05 — — US disclosed
US-20220402915-A1 BCL-2 INHIBITORS BEONE MEDICINES I GMBH (CH) 2022-12-22 — — 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 (2 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-20220402915-A1 BCL-2 INHIBITORS BCL2, BCL2L1, BCL2L2 HTR2A 2862/4885GRM2 2824/4885CHRNB4 4860/4885
US-20230002369-A1 Bcl-2 INHIBITORS BCL2, BCL2L1, BCL2L2 HTR2A 2862/4885GRM2 2824/4885CHRNB4 4860/4885

“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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