SCHEMBL18327576

SCHEMBL18327576

c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4cc(-c5ccccc5)cc(-c5cc6c7ccccc7ccc6c6ccccc56)c4)n3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ HPRT1 P00492 4/20 0.42
▸ CYP11B1 P15538 1/20 0.40
▸ ALDH1A1 P00352 6/20 0.39
▸ HPGD P15428 4/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ HSD17B10 Q99714 4/20 0.38
▸ TSHR P16473 3/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ ATM Q13315 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ NFKB1 P19838 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
SCHEMBL19271453 1.00 MAPT (0.43) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL18327621 0.98 MAPT (0.44) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL18325201 0.93 CYP1A1 (0.42) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL18325333 0.93 CYP1A1 (0.42) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL19271412 0.91 KMT2A (0.44) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL21309357 0.91 HPRT1 (0.48) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL23065684 0.89 CYP11B1 (0.50) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL24473031 0.88 MAPT (0.38) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL23759456 0.88 HPRT1 (0.45) MAPTSMN1; SMN2NPC1LMNARECQL
SCHEMBL23759483 0.88 HPRT1 (0.45) MAPTSMN1; SMN2NPC1LMNARECQL

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-9812652-B2 Cyclic azine compound having adamantyl group, production method, and organic electroluminescent device containing it as constituent component TOSOH CORPORATION (JP) 2017-11-07 — — US disclosed
US-20160372678-A1 CYCLIC AZINE COMPOUND HAVING ADAMANTYL GROUP, PRODUCTION METHOD, AND ORGANIC ELECTROLUMINESCENT DEVICE CONTAINING IT AS CONSTITUENT COMPONENT TOSOH CORPORATION (JP) 2016-12-22 — — 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-20160372678-A1 CYCLIC AZINE COMPOUND HAVING ADAMANTYL GROUP, PRODUCTION METHOD, AND ORGANIC ELECTROLUMINESCENT DEVICE CONTAINING IT AS CONSTITUENT COMPONENT CHRM1, AFF1, AZI2 MAPT 2986/4885SMN1; SMN2 2150/4885NPC1 2628/4885

“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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