SCHEMBL23978587

SCHEMBL23978587

CCN1CC(c2ccc(Cl)cc2)C1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.58
SRD5A1 P18405 2/20 0.46
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
DUSP3 P51452 1/20 0.43
PTPN5 P54829 1/20 0.43
PTPN11 Q06124 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
KMT2A Q03164 2/20 0.42
LSS P48449 2/20 0.42
MEN1 O00255 1/20 0.42
SLC6A3 Q01959 1/20 0.41
HTR3A P46098 1/20 0.41
ADRA1A P35348 1/20 0.41
KDM1A O60341 1/20 0.41
RCOR1 Q9UKL0 1/20 0.41
PROKR1 Q8TCW9 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
SCHEMBL10287616 0.82 DRD2 (0.77) DRD2ALDH1A1MAPTHPGDDUSP3
SCHEMBL24877642 0.79 ESR2 (0.51) ALDH1A1DUSP3PTPN5PTPN11
SCHEMBL25005732 0.79 KDM1A (0.41) DRD2SLC6A3KDM1ARCOR1
SCHEMBL24804654 0.79 DRD2 (0.49) DRD2SRD5A1LSSSLC6A3HTR3A
SCHEMBL19567291 0.78 DRD2 (0.53) DRD2
SCHEMBL22048337 0.78 SRD5A1 (0.53) DRD2SRD5A1LSSSLC6A3HTR3A
SCHEMBL26492730 0.76 DRD2 (0.46) DRD2SRD5A1LSSSLC6A3ADRA1A
SCHEMBL16846492 0.76 SRD5A1 (0.46) DRD2SRD5A1ALDH1A1KMT2ALSS
SCHEMBL23423680 0.75 L3MBTL1 (0.39) DRD2MAPT
SCHEMBL24805422 0.74 DRD2 (0.49) DRD2SRD5A1LSSSLC6A3

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-11643388-B2 Inhibitors of alpha 2 beta 1 integrin and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-05-09 US disclosed
WO-2021222789-A1 INHIBITORS OF ALPHA 2 BETA 1 INTEGRIN AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-11-04 WO 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-11643388-B2 Inhibitors of alpha 2 beta 1 integrin and methods of use thereof ITGB1, ITGB2, ITGA2 DRD2 2870/4885SRD5A1 2451/4885ALDH1A1 399/4885

“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.