SCHEMBL19160652

SCHEMBL19160652

Cn1nnnc1Sc1ccnc2ccc(Cl)cc12

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
HTT P42858 7/20 0.42
PIP4K2C Q8TBX8 7/20 0.42
ADRB2 P07550 1/20 0.42
NR4A2 P43354 1/20 0.42
MAPT P10636 3/20 0.41
PAX8 Q06710 2/20 0.37
TP53 P04637 3/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MITF O75030 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL19160369 0.85 SLC22A12 (0.46) LMNACA12CA1CA2CA9
SCHEMBL18733508 0.85 SLC22A12 (0.44) LMNACA12CA1CA2CA9
SCHEMBL18733512 0.81 TSHR (0.49) LMNACA12CA1CA2CA9
SCHEMBL18732810 0.80 HTT (0.56) LMNAHTTPIP4K2CADRB2PAX8
SCHEMBL19160403 0.76 HTT (0.48) CA12CA1CA2CA9HTT
SCHEMBL31399940 0.74 PIP4K2C (0.49) LMNAHTTPIP4K2CADRB2MAPT
SCHEMBL1147571 0.66 PRNP (0.60) ADRB2NR4A2MAPTHSD17B10
SCHEMBL18732754 0.64 HTT (0.53) LMNAHTTPIP4K2CMAPTPAX8
SCHEMBL18732808 0.64 HTT (0.53) LMNAHTTPIP4K2CADRB2PAX8
SCHEMBL4258179 0.64 GCK (0.43) LMNAHTTMAPTALDH1A1HSD17B10

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-20170210759-A1 ACTIVATORS OF AUTOPHAGIC FLUX AND PHOSPHOLIPASE D AND CLEARANCE OF PROTEIN AGGREGATES INCLUDING TAU AND TREATMENT OF PROTEINOPATHIES THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2017-07-27 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-20170210759-A1 ACTIVATORS OF AUTOPHAGIC FLUX AND PHOSPHOLIPASE D AND CLEARANCE OF PROTEIN AGGREGATES INCLUDING TAU AND TREATMENT OF PROTEINOPATHIES MAPT, SQSTM1, ATG7 LMNA 1009/4885CA12 4872/4885CA1 4650/4885

“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.