SCHEMBL18591230

SCHEMBL18591230

NC(=O)c1cn(CC(=O)O)c2ccc(-c3ccc(N)nc3)cc12

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 1/20 0.44
▸ MKNK2 Q9HBH9 1/20 0.44
▸ ICMT O60725 1/20 0.43
▸ MTOR P42345 3/20 0.40
▸ MAP3K11 Q16584 1/20 0.40
▸ CFD P00746 5/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ PARP1 P09874 1/20 0.38
▸ DHODH Q02127 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ METAP2 P50579 1/20 0.38
▸ MAP4K4 O95819 1/20 0.37
▸ GAA P10253 1/20 0.36

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
SCHEMBL18591224 0.87 ICMT (0.47) ICMTCFDKMT2AALDH1A1KDM4E
SCHEMBL18591234 0.87 ICMT (0.43) ICMTCFDKMT2ADHODHALDH1A1
SCHEMBL29545636 0.86 ICMT (0.48) ICMTCFDKMT2AALDH1A1KDM4E
SCHEMBL18554993 0.86 ICMT (0.48) ICMTCFDKMT2AALDH1A1KDM4E
SCHEMBL18591228 0.84 MKNK1 (0.48) MKNK1MKNK2ICMTMTORCFD
SCHEMBL18591231 0.84 ICMT (0.41) MKNK1MKNK2ICMTMTORMAP3K11
SCHEMBL18554895 0.83 MKNK1 (0.52) MKNK1MKNK2ICMT
SCHEMBL18591236 0.81 CFD (0.44) ICMTCFDKMT2A
SCHEMBL29545899 0.80 ICMT (0.39) ICMTCFDKMT2AALDH1A1KDM4E
SCHEMBL18554967 0.80 ICMT (0.39) ICMTCFDKMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3340983-B1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2023-10-04 — — EP disclosed
US-20200262818-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2020-08-20 — — US disclosed
US-10662175-B2 Aryl, heteroaryl, and heterocyclic compounds for treatment of immune and inflammatory disorders ACHILLION PHARMACEUTICALS, INC. (US) 2020-05-26 — — US disclosed
US-10287301-B2 Aryl, heteroaryl, and heterocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2019-05-14 — — US disclosed
US-20180179186-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2018-06-28 — — US disclosed
US-20170066783-A1 Aryl, Heteroaryl, and Heterocyclic Compounds for Treatment of Medical Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-09 — — US disclosed
US-20170066783-A1 Aryl, Heteroaryl, and Heterocyclic Compounds for Treatment of Medical Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-09 — — 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 (5 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-20170066783-A1 Aryl, Heteroaryl, and Heterocyclic Compounds for Treatment of Medical Disorders CFD, F12, F3 MKNK1 4427/4885MKNK2 4181/4885ICMT 4435/4885
US-20180179186-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS CFD, TFPI, CFH MKNK1 2361/4885MKNK2 2253/4885ICMT 3508/4885
US-20200262818-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS CFD, TFPI, CFH MKNK1 2361/4885MKNK2 2253/4885ICMT 3508/4885
US-10287301-B2 Aryl, heteroaryl, and heterocyclic compounds for treatment of medical disorders CFD, F12, F3 MKNK1 4427/4885MKNK2 4181/4885ICMT 4435/4885
US-10662175-B2 Aryl, heteroaryl, and heterocyclic compounds for treatment of immune and inflammatory disorders CFD, TFPI, CFH MKNK1 2361/4885MKNK2 2253/4885ICMT 3508/4885

“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.

Send feedback