SCHEMBL18158901

SCHEMBL18158901

Brc1cccc(-c2cccc(-c3nc(-c4ccccc4)c4c(n3)sc3ccccc34)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ABCG2 Q9UNQ0 3/20 0.38
▸ ABCB1 P08183 1/20 0.38
▸ ADORA2A P29274 2/20 0.36
▸ ADORA1 P30542 2/20 0.36
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ PTPN1 P18031 1/20 0.35
▸ GABRA1 P14867 1/20 0.35
▸ GABRG2 P18507 1/20 0.35
▸ GABRB3 P28472 1/20 0.35

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
SCHEMBL23628372 0.97 HPGD (0.41) HPGDNPC1TSHRRAB9ASMN1; SMN2
SCHEMBL18017798 0.92 ADORA2A (0.40) HPGDNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18017685 0.92 ADORA2A (0.40) HPGDNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18017800 0.92 ADORA2A (0.40) HPGDNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18370747 0.91 ADORA2A (0.40) HPGDNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18370801 0.91 ADORA2A (0.40) HPGDNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18370779 0.91 ADORA2A (0.40) HPGDNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18370718 0.91 ADORA2A (0.40) HPGDNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18017794 0.91 ADORA2A (0.41) HPGDNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18370749 0.90 ADORA2A (0.39) HPGDMEN1KMT2AADORA2AADORA1

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-20160308142-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-10-20 — — US disclosed
US-20160308142-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-10-20 — — 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-20160308142-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 HPGD 1502/4885NPC1 2421/4885TSHR 4456/4885

“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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