SCHEMBL24775490

SCHEMBL24775490

Cc1cccc(C2CCCN2C(C)C)c1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.46
DRD1 P21728 1/20 0.46
DRD4 P21917 1/20 0.46
DRD5 P21918 1/20 0.46
DRD3 P35462 1/20 0.46
ALDH1A1 P00352 2/20 0.43
MAOB P27338 2/20 0.43
HTR2C P28335 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
PARP1 P09874 2/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40
MAOA P21397 1/20 0.40

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
SCHEMBL27111350 1.00 DRD2 (0.46) DRD2DRD1DRD4DRD5DRD3
SCHEMBL23449295 0.86 DRD2 (0.44) DRD2DRD3PARP1CHRNB2CHRNB4
SCHEMBL4100913 0.83 RIPK1 (0.54) MAOBMAOA
SCHEMBL21725645 0.83 RIPK1 (0.54) MAOBMAOA
SCHEMBL19862549 0.83 MAPK1 (0.45) ALDH1A1MAOBCHRNA7MAOA
SCHEMBL24775502 0.82 DRD2 (0.50) DRD2ALDH1A1HTR2CKDM4EKMT2A
SCHEMBL14213446 0.82 CHRNB2 (0.59) PARP1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL12609019 0.82 CHRNB2 (0.59) PARP1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL2603280 0.82 CHRNB2 (0.59) PARP1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL24040317 0.81 ADAM17 (0.42) DRD2DRD3ALDH1A1KDM4EPARP1

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-20240067631-A1 PYRAZOLE DERIVATIVES USEFUL AS NAMPT MODULATORS CYTOKINETICS, INC. 2024-02-29 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 DRD2 4268/4885DRD1 4647/4885DRD4 4714/4885
US-20240067631-A1 PYRAZOLE DERIVATIVES USEFUL AS NAMPT MODULATORS NAMPT, NNT, NAPRT DRD2 3781/4885DRD1 3402/4885DRD4 4209/4885

“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.