SCHEMBL5470441

SCHEMBL5470441

CCOc1ccc2c(c1)nc(N)n2C

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.70
ACSS2 Q9NR19 1/20 0.55
ALDH1A1 P00352 5/20 0.50
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
HSD17B10 Q99714 2/20 0.50
CYP3A4 P08684 2/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
KDM4E B2RXH2 1/20 0.49
NPC1 O15118 4/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
HPGD P15428 1/20 0.45
ALOX12 P18054 1/20 0.45
CYP2C19 P33261 1/20 0.45
PPARG P37231 1/20 0.45
NCOA2 Q15596 1/20 0.45

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
SCHEMBL5456024 0.82 ALDH1A1 (0.57) MAPTACSS2ALDH1A1KMT2AMEN1
SCHEMBL5458735 0.77 NPC1 (0.49) MAPTACSS2ALDH1A1HSD17B10CYP3A4
SCHEMBL23490723 0.76 NPC1 (0.46) MAPTALDH1A1KMT2AMEN1HSD17B10
SCHEMBL13618551 0.74 RAF1 (0.44) MAPTALDH1A1PPARG
SCHEMBL2734327 0.74 KDM4E (0.52) MAPTALDH1A1KMT2AMEN1HSD17B10
Hydrochloric Acid SCHEMBL6623126 0.73 KDM4E (0.51) MAPTALDH1A1KMT2AMEN1HSD17B10
SCHEMBL11823 0.73 TLR8 (0.58) MAPTACSS2ALDH1A1KMT2AMEN1
SCHEMBL8253380 0.73 SIRT2 (0.52) MAPTALDH1A1KMT2AMEN1CYP3A4
Hydrochloric Acid SCHEMBL11711378 0.72 HTT (0.53) MAPTACSS2ALDH1A1KMT2AMEN1
SCHEMBL18675058 0.72 ACSS2 (1.00) MAPTACSS2

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-20070232673-A1 2-Imino-benzimidazoles ABBOTT LABORATORIES 2007-10-04 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-20070232673-A1 2-Imino-benzimidazoles CYP2C19, UGT2B7, UGT2B17 MAPT 2918/4885ACSS2 392/4885ALDH1A1 39/4885

“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.