SCHEMBL3597710

SCHEMBL3597710

C[CH]Oc1ccc(N2CCN(C)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.53
▸ GAA P10253 3/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ PTK2B Q14289 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ ADRA2C P18825 1/20 0.53
▸ GFER P55789 1/20 0.53
▸ ESR2 Q92731 1/20 0.53
▸ HTR3A P46098 1/20 0.47
▸ SIRT6 Q8N6T7 1/20 0.46
▸ HRH3 Q9Y5N1 1/20 0.46
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ CHKA P35790 1/20 0.44
▸ DRD2 P14416 1/20 0.44
▸ DDB1 Q16531 1/20 0.43
▸ CRBN Q96SW2 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42

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
SCHEMBL3592917 0.81 ADRA2C (0.57) MAPTGAAKDM4EPTK2BADRA2C
SCHEMBL424503 0.79 DRD2 (0.66) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL5210507 0.76 GAA (0.55) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL3593153 0.75 ALDH1A1 (0.69) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL6917541 0.74 MAPT (0.53) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL12929952 0.74 ALDH1A1 (0.53) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL8363117 0.74 KMT2A (0.66) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL17144028 0.73 F10 (0.64) MAPTKMT2AHTR3ANPC1RAB9A
SCHEMBL2056171 0.73 ALDH1A1 (0.59) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL5210514 0.73 GAA (0.52) MAPTGAAALDH1A1KDM4EPTK2B

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-20100029636-A1 Lck inhibitors NOVARTIS AG (CH) 2010-02-04 — — 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-20100029636-A1 Lck inhibitors LCK, ZAP70, FYN MAPT 2260/4885GAA 3549/4885ALDH1A1 4236/4885

“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.

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