SCHEMBL4935781

SCHEMBL4935781

CCN1CCN(Cc2ccc(N)c(Cl)c2)CC1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
SIGMAR1 Q99720 2/20 0.53
SMN1; SMN2 Q16637 3/20 0.50
POLB P06746 2/20 0.50
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.48
LMNA P02545 1/20 0.47
NPC1 O15118 4/20 0.46
TP53 P04637 4/20 0.46
RAB9A P51151 3/20 0.46
KDM4E B2RXH2 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GAA P10253 1/20 0.45
RAD52 P43351 1/20 0.45
MAPT P10636 1/20 0.44
HTR6 P50406 1/20 0.43

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
SCHEMBL22164008 0.87 LMNA (0.65) ALDH1A1SIGMAR1SMN1; SMN2POLBCYP3A4
SCHEMBL16054965 0.85 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2POLBTSHRLMNA
SCHEMBL9612032 0.85 POLB (0.69) ALDH1A1SIGMAR1SMN1; SMN2POLBCYP3A4
SCHEMBL374400 0.79 LMNA (0.72) ALDH1A1SIGMAR1SMN1; SMN2POLBTSHR
SCHEMBL4950181 0.77 GAA (0.69) SIGMAR1SMN1; SMN2LMNAKDM4EKMT2A
SCHEMBL12717312 0.77 ALDH1A1 (0.71) ALDH1A1SIGMAR1SMN1; SMN2POLBTSHR
SCHEMBL17010820 0.76 ALDH1A1 (0.59) ALDH1A1SIGMAR1SMN1; SMN2POLBTSHR
SCHEMBL28088901 0.76 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2POLBLMNANPC1
SCHEMBL18049339 0.75 ALDH1A1 (0.69) ALDH1A1SIGMAR1SMN1; SMN2POLBTSHR
SCHEMBL26358413 0.75 NPC1 (0.60) ALDH1A1SMN1; SMN2NPC1TP53RAB9A

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-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases BOLD GUIDO 2008-12-18 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-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases RET, PRKDC, PRKACA ALDH1A1 3290/4885SIGMAR1 4157/4885SMN1; SMN2 849/4885

“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.