SCHEMBL7110306

SCHEMBL7110306

CCNc1ccc(C(C)N2CCCCC2)c(NC)c1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.32
SLC6A3 Q01959 2/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CHRNA1 P02708 1/20 0.32
CHRNG P07510 1/20 0.32
CHRNB1 P11230 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
CHRND Q07001 1/20 0.32
AVPR2 P30518 2/20 0.31
P2RX3 P56373 1/20 0.31
ELANE P08246 1/20 0.31
USP2 O75604 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL7247744 0.71 CYP2D6 (0.41) SLC6A2SLC6A3MAPTALDH1A1POLB
SCHEMBL6705805 0.71 SLC6A3 (0.37) SLC6A3MAPTALDH1A1POLBGAA
SCHEMBL13487422 0.64 MAPT (0.37) SLC6A2MAPTALDH1A1POLBSMN1; SMN2
SCHEMBL6708632 0.62 MAPT (0.32) SLC6A3MAPTALDH1A1GAAHTT
SCHEMBL9125453 0.62 TSHR (0.32)
SCHEMBL12257144 0.61 MAPT (0.59) MAPTALDH1A1POLBSMN1; SMN2TDP1
Hydrochloric Acid SCHEMBL9014023 0.60 MAPT (0.58) MAPTALDH1A1POLBSMN1; SMN2TDP1
SCHEMBL8934380 0.60 TSHR (0.33) ALDH1A1
SCHEMBL11310009 0.59 ALDH1A1 (0.42) MAPTALDH1A1
SCHEMBL24783702 0.59 MAPT (0.34) MAPTALDH1A1POLBP2RX3

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-20030110579-A1 Method for colouring hair THE PROCTER & GAMBLE COMPANY (US) 2003-06-19 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-20030110579-A1 Method for colouring hair COX5B, SHH, DNMT3A SLC6A2 4662/4885SLC6A3 4274/4885MAPT 3941/4885

“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.