SCHEMBL3740523

SCHEMBL3740523

CCc1nc(-c2ncccn2)sc1C(=O)NC(C)CC(=O)N(C)C

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.38
ZAP70 P43403 2/20 0.33
SYK P43405 2/20 0.33
POLB P06746 1/20 0.33
NAMPT P43490 1/20 0.32
LMNA P02545 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
PDE2A O00408 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KIFC1 Q9BW19 2/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
RCE1 Q9Y256 1/20 0.30

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
SCHEMBL3746386 0.76 CNR2 (0.35) THRBZAP70SYKKDM4EGAA
SCHEMBL26791923 0.76 TRPM8 (0.38) THRBPOLBLMNAALDH1A1RAB9A
SCHEMBL3742906 0.76 ALDH1A1 (0.45) LMNAALDH1A1KDM4EMEN1KMT2A
SCHEMBL3749715 0.76 ALDH1A1 (0.45) LMNAALDH1A1KDM4EMEN1KMT2A
SCHEMBL3751397 0.75 KDM4E (0.46) POLBLMNAALDH1A1RAB9AKDM4E
SCHEMBL3743362 0.75 TLR8 (0.37) THRB
SCHEMBL3749711 0.74 SCN9A (0.35) LMNAALDH1A1KDM4EGAATDP1
SCHEMBL3751929 0.73 ROCK2 (0.48) RAB9AKMT2A
SCHEMBL26795528 0.73 TRPM8 (0.39) POLBLMNAALDH1A1RAB9AKDM4E
SCHEMBL3744085 0.72 P2RX7 (0.39) THRBLMNAKDM4EGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9133204-B2 5-membered heterocyclic amides and related compounds H. LUNDBECK A/S (DK) 2015-09-15 US disclosed
US-9133204-B2 5-membered heterocyclic amides and related compounds H. LUNDBECK A/S (DK) 2015-09-15 US disclosed
US-9133204-B2 5-membered heterocyclic amides and related compounds H. LUNDBECK A/S (DK) 2015-09-15 US disclosed
EP-2178865-B1 5-MEMBERED HETEROCYCLIC AMIDES AND RELATED COMPOUNDS LUNDBECK H AS (DK) 2015-08-19 EP disclosed
EP-2178865-B1 5-MEMBERED HETEROCYCLIC AMIDES AND RELATED COMPOUNDS LUNDBECK H AS (DK) 2015-08-19 EP disclosed
US-20150005293-A1 5-Membered Heterocyclic Amides And Related Compounds MINDIMMUNE THERAPEUTICS, INC. 2015-01-01 US disclosed
US-20150005293-A1 5-Membered Heterocyclic Amides And Related Compounds MINDIMMUNE THERAPEUTICS, INC. 2015-01-01 US disclosed
US-20150005293-A1 5-Membered Heterocyclic Amides And Related Compounds MINDIMMUNE THERAPEUTICS, INC. 2015-01-01 US disclosed
US-20100292236-A1 5-Membered Heterocyclic Amides And Related Compounds H. LUNDBECK A/S (DK) 2010-11-18 US disclosed
US-20100292236-A1 5-Membered Heterocyclic Amides And Related Compounds H. LUNDBECK A/S (DK) 2010-11-18 US disclosed
US-20100292236-A1 5-Membered Heterocyclic Amides And Related Compounds H. LUNDBECK A/S (DK) 2010-11-18 US disclosed
WO-2009012482-A2 5-MEMBERED HETEROCYCLIC AMIDES AND RELATED COMPOUNDS H.LUNDBECK A/S (DK) 2009-01-22 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-20150005293-A1 5-Membered Heterocyclic Amides And Related Compounds GPR35, HCAR2, HCAR1 THRB 225/4885ZAP70 2822/4885SYK 3450/4885
US-20100292236-A1 5-Membered Heterocyclic Amides And Related Compounds GPR35, HCAR2, HCAR1 THRB 225/4885ZAP70 2822/4885SYK 3450/4885

“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.