SCHEMBL18057974

SCHEMBL18057974

CC1(C)c2ccccc2-c2ccc3c4ccc5cccnc5c4n(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FABP1 P07148 2/20 0.34
▸ CCR1 P32246 3/20 0.33
▸ CCR5 P51681 3/20 0.33
▸ CCR8 P51685 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ KDM4E B2RXH2 3/20 0.32
▸ MAPT P10636 3/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ LMNA P02545 2/20 0.32
▸ GMNN O75496 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ MMP2 P08253 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ MMP9 P14780 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ MMP8 P22894 1/20 0.32

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
SCHEMBL18057907 0.89 FABP1 (0.32) FABP1CCR1CCR5CCR8L3MBTL1
SCHEMBL15434215 0.88 L3MBTL1 (0.35) L3MBTL1KDM4EMAPTTDP1TP53
SCHEMBL18059360 0.88 — —
SCHEMBL18057980 0.87 L3MBTL1 (0.34) FABP1CCR1CCR5CCR8L3MBTL1
SCHEMBL13965971 0.87 FABP1 (0.30) FABP1
SCHEMBL18057977 0.86 MAPT (0.34) L3MBTL1KDM4EMAPTTDP1LMNA
SCHEMBL18058246 0.86 CSNK2A2 (0.33) —
SCHEMBL18059338 0.86 ACVR1 (0.32) MAPTLMNAHSP90AA1CYP3A4MMP9
SCHEMBL18057987 0.83 PDE10A (0.34) FABP1CCR1CCR5CCR8L3MBTL1
SCHEMBL18057946 0.83 ABCB1 (0.32) NPC1ABCG2

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-10680183-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2020-06-09 — — US disclosed
US-20160260909-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2016-09-08 — — US disclosed
US-20160260909-A1 Organic Electroluminescent Materials and Devices UNIVERSAL DISPLAY CORPORATION 2016-09-08 — — 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-10680183-B2 Organic electroluminescent materials and devices PNMT, CYCS, NES FABP1 3149/4885CCR1 3974/4885CCR5 2377/4885
US-20160260909-A1 Organic Electroluminescent Materials and Devices PNMT, CYCS, NES FABP1 3149/4885CCR1 3974/4885CCR5 2377/4885

“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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