SCHEMBL14555428

SCHEMBL14555428

CC(C)c1ncccc1-c1ccc(C(N)=O)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 8/20 0.68
▸ MKNK2 Q9HBH9 8/20 0.68
▸ CAMKK2 Q96RR4 2/20 0.52
▸ CHEK2 O96017 4/20 0.46
▸ RIPK1 Q13546 1/20 0.46
▸ CHUK O15111 2/20 0.43
▸ IKBKB O14920 1/20 0.43
▸ AR P10275 1/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ NFKB1 P19838 1/20 0.41

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
SCHEMBL15723878 0.86 MKNK1 (0.49) MKNK1MKNK2CAMKK2NPC1RAB9A
SCHEMBL18853950 0.84 PRKCI (0.50) MKNK1MKNK2CHEK2ARNPC1
SCHEMBL15723882 0.82 MKNK1 (0.52) MKNK1MKNK2CHEK2RIPK1NPC1
SCHEMBL15723884 0.82 CYP1A2 (0.46) MKNK1MKNK2CHEK2RIPK1KDM4E
SCHEMBL15730267 0.81 MKNK1 (1.00) MKNK1MKNK2CAMKK2CHEK2RIPK1
SCHEMBL944527 0.79 MKNK1 (0.42) MKNK1MKNK2ARCDC7CDK8
SCHEMBL27914704 0.79 MKNK1 (0.71) MKNK1MKNK2CAMKK2CHEK2RIPK1
SCHEMBL28226910 0.79 MKNK1 (0.76) MKNK1MKNK2CAMKK2CHEK2RIPK1
SCHEMBL26627849 0.78 USP7 (0.44) MKNK1MKNK2RIPK1NPC1RAB9A
SCHEMBL14555836 0.77 MKNK1 (0.45) MKNK1MKNK2CDC7LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180194746-A1 Compounds For the Treatment of HIV GILEAD SCIENCES, INC. 2018-07-12 — — US disclosed
US-9944619-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2018-04-17 — — US disclosed
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2017-05-18 — — US disclosed
WO-2013006738-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2013-01-10 — — WO 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-20180194746-A1 Compounds For the Treatment of HIV CCR5, NPC1, FURIN MKNK1 2159/4885MKNK2 2342/4885CAMKK2 4642/4885
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN MKNK1 2159/4885MKNK2 2342/4885CAMKK2 4642/4885

“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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