SCHEMBL14016156

SCHEMBL14016156

CN(C)CCN1CCc2cc(I)ccc21

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.63
ALDH1A1 P00352 3/20 0.63
LMNA P02545 3/20 0.63
KDM4E B2RXH2 3/20 0.63
PTK2B Q14289 1/20 0.63
ESR2 Q92731 1/20 0.63
NOS3 P29474 7/20 0.49
NOS1 P29475 7/20 0.49
NOS2 P35228 3/20 0.49
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
USP2 O75604 1/20 0.41
CDK4 P11802 1/20 0.41
ALOX15 P16050 1/20 0.41
CCND1 P24385 1/20 0.41
SIGMAR1 Q99720 4/20 0.36
KCNH2 Q12809 3/20 0.35
SLC6A4 P31645 2/20 0.35
HRH1 P35367 2/20 0.35
HTR3E A5X5Y0 1/20 0.35

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
SCHEMBL25818505 0.83 ALDH1A1 (0.65) MAPTALDH1A1LMNAKDM4EPTK2B
SCHEMBL188501 0.82 ALDH1A1 (0.63) MAPTALDH1A1LMNAKDM4EPTK2B
SCHEMBL27749840 0.80 ACHE (0.43) MAPTALDH1A1LMNAKDM4EPTK2B
SCHEMBL24109783 0.79 KDM4E (0.60) MAPTALDH1A1LMNAKDM4EPTK2B
SCHEMBL13960940 0.79 NOTUM (0.47) MAPTALDH1A1LMNAKDM4EPTK2B
SCHEMBL7680979 0.78 ALDH1A1 (1.00) MAPTALDH1A1LMNAKDM4EPTK2B
SCHEMBL4502603 0.77 NOS3 (0.48) ALDH1A1NOS3NOS1NOS2MEN1
SCHEMBL1951649 0.76 LMNA (0.56) MAPTALDH1A1LMNAKDM4EPTK2B
SCHEMBL27334728 0.75 LMNA (0.55) MAPTALDH1A1LMNAKDM4EPTK2B
SCHEMBL25818515 0.75 ALDH1A1 (0.54) MAPTALDH1A1LMNAKDM4EPTK2B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors ALTANA PHARMA AG (DE) 2008-10-02 US disclosed
US-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors ALTANA PHARMA AG (DE) 2008-10-02 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-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors MAP3K19, MAP3K6, MAP3K20 MAPT 4521/4885ALDH1A1 2988/4885LMNA 4261/4885

“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.