SCHEMBL21968630

SCHEMBL21968630

c1ccc(-c2ccc(N(c3ccccc3)c3cccc4c3sc3c(N(c5ccccc5)c5ccc6c(c5)sc5ccccc56)cccc34)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALOX5 P09917 1/20 0.36
GPR3 P46089 1/20 0.36
LIMK1 P53667 2/20 0.34
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
F9 P00740 1/20 0.34
APP P05067 1/20 0.32
ABCB1 P08183 1/20 0.31

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
SCHEMBL21968632 1.00 ALDH1A1 (0.38) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL21966027 0.96 ALOX5 (0.39) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL21966645 0.96 ALOX5 (0.39) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL22146935 0.96 ALOX5 (0.39) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL21968631 0.95 ALDH1A1 (0.41) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL12960037 0.94 ALOX5 (0.39) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL24000252 0.94 ALOX5 (0.40) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL21966464 0.93 ALOX5 (0.36) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL21966029 0.93 ALOX5 (0.36) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL21973756 0.93 ALOX5 (0.36) ALDH1A1MAPTHPGDRAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200176685-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-06-04 US disclosed
US-20200144510-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-05-07 US disclosed
US-20200144508-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-05-07 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-20200144508-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE OCIAD1, OCIAD2, OR10J3 ALDH1A1 49/4885MAPT 2375/4885HPGD 2197/4885

“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.