SCHEMBL27170376

SCHEMBL27170376

C(=Nc1ccncc1)c1ccncc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 2/20 0.43
MAPT P10636 2/20 0.43
THRB P10828 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40

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
SCHEMBL19241690 1.00 ALDH1A1 (0.43) ALDH1A1L3MBTL1KDM4EMEN1MAPT
SCHEMBL19242052 0.95 ALDH1A1 (0.48) ALDH1A1L3MBTL1KDM4EMEN1MAPT
SCHEMBL31291027 0.95 ALDH1A1 (0.48) ALDH1A1L3MBTL1KDM4EMEN1MAPT
SCHEMBL19242050 0.95 ALDH1A1 (0.48) ALDH1A1L3MBTL1KDM4EMEN1MAPT
SCHEMBL11398887 0.89 CA1 (0.53) ALDH1A1L3MBTL1KDM4EMAPTCA1
SCHEMBL19241980 0.89 ALDH1A1 (0.44) ALDH1A1L3MBTL1KDM4EMEN1MAPT
SCHEMBL11557326 0.89 CA1 (0.53) ALDH1A1L3MBTL1KDM4EMAPTCA1
SCHEMBL3271745 0.89 ALDH1A1 (0.53) ALDH1A1L3MBTL1KDM4EMAPTCA1
SCHEMBL10616606 0.89 ALDH1A1 (0.53) ALDH1A1L3MBTL1KDM4EMAPTCA1
SCHEMBL19241981 0.89 MAPT (0.44) ALDH1A1L3MBTL1KDM4EMEN1MAPT

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-12613191-B2 Multiplexed Raman molecular imaging UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2026-04-28 US disclosed
US-20240085335-A1 MULTIPLEXED RAMAN MOLECULAR IMAGING UNIVERSITY OF SOUTHERN CALIFORNIA 2024-03-14 US disclosed
WO-2022157674-A1 MULTIPLEXED RAMAN MOLECULAR IMAGING UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2022-07-28 WO 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-12613191-B2 Multiplexed Raman molecular imaging FABP1, SCNN1G, VIL1 ALDH1A1 164/4885L3MBTL1 1251/4885KDM4E 4086/4885

“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.