SCHEMBL5457985

SCHEMBL5457985

CCOc1ccc(F)cc1NC(=O)Nc1ccc(N2CCN(C(=O)Nc3ncccc3C)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
MAPT P10636 5/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TRPV1 Q8NER1 2/20 0.45
P2RY1 P47900 2/20 0.43
POLB P06746 2/20 0.43
TP53 P04637 1/20 0.43
BLM P54132 1/20 0.43
GLA P06280 1/20 0.43
HTR1A P08908 1/20 0.43
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43
HTR2A P28223 1/20 0.43
SSTR2 P30874 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 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
SCHEMBL5465924 0.91 KDM4E (0.46) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL5463477 0.90 TRPV1 (0.53) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL5462591 0.88 MAPT (0.49) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL5459861 0.84 MAPT (0.50) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL5451470 0.84 MAPT (0.49) NPC1MAPTALDH1A1SMN1; SMN2POLB
SCHEMBL5467111 0.83 MAPT (0.51) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL5460431 0.83 MAPT (0.54) NPC1MAPTALDH1A1SMN1; SMN2POLB
SCHEMBL5464810 0.82 KMT2A (0.54) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL5466986 0.81 P2RY1 (0.51) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL5460880 0.81 MAPT (0.49) NPC1RAB9AMAPTALDH1A1SMN1; SMN2

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-20070249620-A1 Urea Derivative SANKYO COMPANY, LIMITED (JP) 2007-10-25 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-20070249620-A1 Urea Derivative UGP2, SLC14A1, DGAT1 NPC1 1089/4885RAB9A 1528/4885MAPT 758/4885

“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.