SCHEMBL25442295

SCHEMBL25442295

CC(C)C1CCN(C(=O)[C@H](Nc2ccccc2)C2CCCCC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 1/20 0.49
▸ CHRM3 P20309 5/20 0.47
▸ TSHR P16473 1/20 0.44
▸ MEN1 O00255 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTR1E P28566 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ S1PR3 Q99500 1/20 0.42
▸ CTSL P07711 2/20 0.40
▸ CTSK P43235 2/20 0.40
▸ CTSB P07858 1/20 0.40
▸ EPHX2 P34913 3/20 0.40
▸ CTSV O60911 1/20 0.40
▸ CTSS P25774 1/20 0.40
▸ ACKR3 P25106 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ ENPP2 Q13822 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
SCHEMBL25442293 1.00 CCR1 (0.49) CCR1CHRM3TSHRMEN1LMNA
SCHEMBL25443139 0.89 CCR1 (0.50) CCR1CHRM3TSHRMEN1LMNA
SCHEMBL25442294 0.88 CCR1 (0.53) CCR1LMNAMAPTCTSLCTSK
SCHEMBL25442292 0.88 CCR1 (0.53) CCR1LMNAMAPTCTSLCTSK
SCHEMBL25443246 0.83 CCR1 (0.43) CCR1CHRM3MEN1LMNAKMT2A
SCHEMBL25443244 0.83 CCR1 (0.43) CCR1CHRM3MEN1LMNAKMT2A
SCHEMBL25443138 0.81 CCR1 (0.41) CCR1CHRM3MEN1KMT2AEPHX2
SCHEMBL28503861 0.78 NPC1 (0.51) TSHRMEN1LMNAMAPTHTR1E
SCHEMBL23903537 0.78 CCR1 (0.50) CCR1KMT2ACTSLCTSKCTSB
SCHEMBL25443247 0.76 CCR1 (0.51) CCR1LMNAMAPTCTSLCTSK

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-20230142739-A1 PROTEIN-PROTEIN INTERACTION STABILIZERS UNIV CALIFORNIA (US) 2023-05-11 — — 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-20230142739-A1 PROTEIN-PROTEIN INTERACTION STABILIZERS HSPBP1, HSPA8, HSPH1 CCR1 4742/4885CHRM3 4882/4885TSHR 3608/4885

“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