SCHEMBL23074644

SCHEMBL23074644

Cc1ccc(OCCN(CCOc2ccc(C)cc2)C2CCCCCCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.51
▸ KCNH2 Q12809 1/20 0.50
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ HRH3 Q9Y5N1 2/20 0.46
▸ TRPM8 Q7Z2W7 1/20 0.43
▸ DRD2 P14416 1/20 0.41
▸ DRD4 P21917 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ NFE2L2 Q16236 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39

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
SCHEMBL23074674 0.84 HRH3 (0.47) KCNH2MEN1KMT2AHRH3NFE2L2
SCHEMBL15759205 0.84 KDM4E (0.51) KDM4EKCNH2MEN1KMT2AHRH3
SCHEMBL23074708 0.84 F2 (0.41) KDM4EMEN1KMT2AALDH1A1
SCHEMBL23074697 0.84 HTR2A (0.47) KDM4EMEN1KMT2AHRH3NFE2L2
SCHEMBL23074671 0.83 ALDH1A1 (0.53) ALDH1A1
SCHEMBL23074677 0.83 HRH3 (0.50) KDM4EMEN1KMT2AHRH3NFE2L2
SCHEMBL23074692 0.83 KMT2A (0.48) KDM4EMEN1KMT2AHRH3NFE2L2
SCHEMBL23074711 0.82 MEN1 (0.52) KDM4EMEN1KMT2ADRD2DRD4
SCHEMBL23074699 0.81 ALDH1A1 (0.43) NFE2L2ALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL23074701 0.81 ALDH1A1 (0.43) NFE2L2ALDH1A1CYP1A2CYP2D6CYP2C19

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-20210069692-A1 ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE CHROMATOGRAPHY RESINS BIO-RAD LABORATORIES, INC. 2021-03-11 — — 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-20210069692-A1 ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE CHROMATOGRAPHY RESINS ABCG2, SLC7A1, MSR1 KDM4E 3830/4885KCNH2 1383/4885MEN1 3364/4885

“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.

Send feedback