SCHEMBL20067656

SCHEMBL20067656

CN1CCN(Cc2ccc(-c3cccc(N=C=S)c3)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHKA P35790 10/20 0.54
MC4R P32245 1/20 0.47
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
HDAC1 Q13547 1/20 0.45
LMNA P02545 1/20 0.44
SUCNR1 Q9BXA5 1/20 0.44
CA2 P00918 1/20 0.44
NCF1 P14598 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
RAB9A P51151 1/20 0.43
TNIK Q9UKE5 1/20 0.43

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
SCHEMBL5002886 0.82 LMNA (0.56) CHKAMC4RLMNACA2NCF1
SCHEMBL8265281 0.77 CHKA (0.64) CHKAMC4RCYP2D6CYP2C19HDAC1
SCHEMBL3687427 0.76 CHKA (0.87) CHKAMC4RCYP2D6CYP2C19HDAC1
SCHEMBL26378533 0.76 CHKA (0.62) CHKAMC4RCYP2D6CYP2C19HDAC1
SCHEMBL20067657 0.76 LMNA (0.64) CHKAMC4RCYP2D6CYP2C19HDAC1
SCHEMBL26378167 0.74 CHKA (0.59) CHKAMC4RCYP2D6CYP2C19HDAC1
SCHEMBL4369145 0.73 ALDH1A1 (0.46) CHKAMC4RCYP2D6LMNA
SCHEMBL20067658 0.72 CHKA (0.54) CHKAMC4RCYP2D6CYP2C19HDAC1
SCHEMBL21495134 0.72 MC4R (0.71) CHKAMC4RNPC1TP53RAB9A
SCHEMBL24061112 0.72 NMT1 (0.57) CHKAMC4RLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3523292-B1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS DONG A SOCIO HOLDINGS CO LTD (KR) 2021-12-15 EP disclosed
US-20210371398-A1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS DONG A SOCIO HOLDINGS CO LTD (KR) 2021-12-02 US disclosed
US-10913730-B2 Heteroaryl compounds and their use as Mer inhibitors DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2021-02-09 US disclosed
US-20190315716-A1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS DONG-A ST CO., LTD. (KR) 2019-10-17 US disclosed
WO-2018071343-A1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2018-04-19 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 (3 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-10913730-B2 Heteroaryl compounds and their use as Mer inhibitors MERTK, RET, ERBB4 CHKA 1738/4885MC4R 94/4885CYP2D6 1334/4885
US-20190315716-A1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS MERTK, RET, ERBB4 CHKA 1738/4885MC4R 94/4885CYP2D6 1334/4885
US-20210371398-A1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS MERTK, RET, ERBB2 CHKA 1780/4885MC4R 180/4885CYP2D6 1056/4885

“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.