SCHEMBL25565610

SCHEMBL25565610

CCCc1ccc(CN2CCN(CCO)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.66
GAA P10253 2/20 0.61
MEN1 O00255 1/20 0.61
NPC1 O15118 1/20 0.61
TP53 P04637 1/20 0.61
RAB9A P51151 1/20 0.61
KMT2A Q03164 1/20 0.61
PKM P14618 1/20 0.54
MBTD1 Q05BQ5 1/20 0.53
L3MBTL3 Q96JM7 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
LMNA P02545 3/20 0.49
POLB P06746 2/20 0.49
TSHR P16473 2/20 0.49
THRB P10828 1/20 0.49
HPGD P15428 1/20 0.49
HRH3 Q9Y5N1 3/20 0.47
CCR3 P51677 1/20 0.47
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL12504054 0.86 ALDH1A1 (0.65) ALDH1A1GAAMEN1NPC1TP53
SCHEMBL13061368 0.84 LMNA (0.65) ALDH1A1NPC1TP53RAB9AMBTD1
SCHEMBL16122104 0.82 ALDH1A1 (0.65) ALDH1A1GAAMEN1NPC1TP53
SCHEMBL22876979 0.81 ALDH1A1 (0.56) ALDH1A1GAAMEN1NPC1TP53
SCHEMBL3979002 0.80 SIGMAR1 (0.63) ALDH1A1GAAMEN1NPC1TP53
SCHEMBL13228061 0.80 HRH3 (0.68) ALDH1A1MEN1KMT2AMBTD1L3MBTL3
SCHEMBL21550461 0.79 DUSP3 (0.60) ALDH1A1GAAMEN1NPC1TP53
SCHEMBL5878453 0.79 PKM (0.57) ALDH1A1GAAMEN1NPC1TP53
SCHEMBL15390746 0.79 LMNA (0.62) ALDH1A1NPC1TP53RAB9AMBTD1
SCHEMBL17976330 0.79 LMNA (0.68) ALDH1A1GAAMEN1NPC1TP53

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-20230158157-A1 POTENT AND SELECTIVE DEGRADERS OF ALK DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-05-25 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-20230158157-A1 POTENT AND SELECTIVE DEGRADERS OF ALK ALK, ERBB2, PDGFRB ALDH1A1 2106/4885GAA 157/4885MEN1 3593/4885

“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.