SCHEMBL5451204

SCHEMBL5451204

COc1ccccc1Nc1ccccc1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.58
ALDH1A1 P00352 4/20 0.58
GAA P10253 2/20 0.58
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
MAPK1 P28482 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.51
KDM4E B2RXH2 2/20 0.51
KMT2A Q03164 1/20 0.51
HPGD P15428 1/20 0.51
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
POLB P06746 2/20 0.50
MAPK10 P53779 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA4 P22748 1/20 0.48
CA7 P43166 1/20 0.48

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
SCHEMBL3191755 0.89 MAPT (0.69) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL5923798 0.87 MAPT (0.67) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL2927671 0.84 POLB (0.56) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL29999663 0.84 POLB (0.56) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL5608757 0.83 CYP1A2 (0.55) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL9629646 0.83 GAA (0.59) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL16001849 0.82 TAAR1 (0.51)
SCHEMBL10784214 0.82 ALDH1A1 (0.57) MAPTALDH1A1GAAMAPK1L3MBTL1
SCHEMBL29511793 0.82 HTT (0.59) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL183017 0.82 HTT (0.59) MAPTALDH1A1GAANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070249620-A1 Urea Derivative SANKYO COMPANY, LIMITED (JP) 2007-10-25 US disclosed
EP-1764360-A1 UREA DERIVATIVE Sankyo Company, Limited (JP) 2007-03-21 EP disclosed
US-4362893-A Preparation of C-nitrosodiarylamines from diarylamines UOP INC. (US) 1982-12-07 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 MAPT 758/4885ALDH1A1 731/4885GAA 2221/4885

“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.