SCHEMBL20222631

SCHEMBL20222631

c1ccc(-c2cc(-c3cnc(-c4ccccc4)nc3)nc(-c3ccc4c(c3)-c3ccccc3Sc3ccccc3-c3ccccc3-c3ccccc3-4)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.43
▸ KMT2A Q03164 7/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ MAPT P10636 5/20 0.43
▸ HPGD P15428 5/20 0.43
▸ NTSR1 P30989 1/20 0.43
▸ NPC1 O15118 2/20 0.39
▸ NFKB1 P19838 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ NFKB2 Q00653 2/20 0.39
▸ RELA Q04206 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ HPGDS O60760 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ GLA P06280 1/20 0.39
▸ MAOB P27338 3/20 0.39
▸ MAOA P21397 2/20 0.39
▸ ADORA2A P29274 1/20 0.38
▸ ADORA1 P30542 1/20 0.38

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
SCHEMBL20222815 0.96 MEN1 (0.41) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20222670 0.96 MEN1 (0.44) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20222672 0.91 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20222566 0.89 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20222819 0.88 MAPT (0.36) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20845241 0.87 MEN1 (0.39) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20222656 0.87 KMT2A (0.33) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20222710 0.85 MEN1 (0.34) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20222839 0.85 MEN1 (0.43) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL20222565 0.85 MEN1 (0.43) MEN1KMT2AALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10693077-B2 Compound and organic electronic device using the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2020-06-23 — — US disclosed
US-20180155312-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME NICHEM FINE TECHNOLOGY CO., LTD. (TW) 2018-06-07 — — 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 (2 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-10693077-B2 Compound and organic electronic device using the same SOD1, SCO2, RCOR3 MEN1 2385/4885KMT2A 1209/4885ALDH1A1 1162/4885
US-20180155312-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME SOD1, SCO2, RCOR3 MEN1 2385/4885KMT2A 1209/4885ALDH1A1 1162/4885

“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.

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