SCHEMBL18615928

SCHEMBL18615928

C#Cc1cccc(NC(=O)N2CCOc3ccc(Oc4ccc(C#N)cc4)cc32)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
THRB P10828 2/20 0.46
TP53 P04637 2/20 0.46
GPR142 Q7Z601 4/20 0.45
LMNA P02545 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
ALDH1A1 P00352 4/20 0.41
NPC1 O15118 1/20 0.41
NFKB1 P19838 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDR P35968 4/20 0.41
LCK P06239 3/20 0.41
MET P08581 3/20 0.41
TEK Q02763 3/20 0.41
POLB P06746 1/20 0.40
USP2 O75604 2/20 0.40
CYP3A4 P08684 2/20 0.40

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
SCHEMBL18615587 0.93 KDR (0.47) MAPTGPR142LMNARXFP1KDR
SCHEMBL18615555 0.86 PTGDR2 (0.46) MAPTTHRBTP53GPR142LMNA
SCHEMBL18615347 0.81 MAPT (0.51) MAPTTHRBTP53LMNARXFP1
SCHEMBL18615705 0.81 MAPT (0.46) MAPTTHRBTP53LMNARXFP1
SCHEMBL18615929 0.80 MAPT (0.48) MAPTTHRBTP53LMNARXFP1
SCHEMBL18615997 0.79 KDR (0.50) MAPTTHRBTP53LMNARXFP1
SCHEMBL18615372 0.79 KDR (0.46) MAPTTHRBTP53GPR142LMNA
SCHEMBL18615586 0.76 MEN1 (0.61) MAPTTP53LMNAALDH1A1NPC1
SCHEMBL20357558 0.74 MAPT (0.52) MAPTTHRBTP53LMNARXFP1
SCHEMBL18615354 0.73 KDR (0.51) MAPTTHRBTP53LMNARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108026035-B Compounds having protein tyrosine phosphatase SHP-1 agonist activity 陈昆锋 2021-03-30 CN disclosed
US-10745346-B2 Agonists of protein tyrosine phosphatase SHP-1 NATIONAL YANG MING CHIAO TUNG UNIVERSITY (TW) 2020-08-18 US disclosed
US-10745346-B2 Agonists of protein tyrosine phosphatase SHP-1 NATIONAL YANG MING CHIAO TUNG UNIVERSITY (TW) 2020-08-18 US disclosed
US-20180237385-A1 AGONISTS OF PROTEIN TYROSINE PHOSPHATASE SHP-1 NATIONAL TAIWAN UNIVERSITY (TW) 2018-08-23 US disclosed
EP-3345894-A1 COMPOUND HAVING PROTEIN TYROSINE PHOSPHATASE SHP-1 AGONIST ACTIVITY Chen, Kuenfeng (TW) 2018-07-11 EP disclosed
WO-2017036405-A1 COMPOUND HAVING PROTEIN TYROSINE PHOSPHATASE SHP-1 AGONIST ACTIVITY 陈昆锋 2017-03-09 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-20180237385-A1 AGONISTS OF PROTEIN TYROSINE PHOSPHATASE SHP-1 PTPRCAP, PTPN18, PTPN1 MAPT 4678/4885THRB 400/4885TP53 424/4885
US-10745346-B2 Agonists of protein tyrosine phosphatase SHP-1 PTPRCAP, PTPN18, PTPN1 MAPT 4678/4885THRB 400/4885TP53 424/4885

“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.