SCHEMBL21855993

SCHEMBL21855993

COCCNc1ncc[c]c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.41
ALDH1A1 P00352 8/20 0.40
KDM4E B2RXH2 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LDHA P00338 1/20 0.40
LMNA P02545 4/20 0.39
HTT P42858 1/20 0.39
MKNK1 Q9BUB5 1/20 0.38
MAPK1 P28482 4/20 0.37
HIF1A Q16665 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CYP1A2 P05177 7/20 0.36
CYP3A4 P08684 6/20 0.36
CLK4 Q9HAZ1 6/20 0.36
CYP2C19 P33261 5/20 0.36
HSD17B10 Q99714 4/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
USP2 O75604 3/20 0.35

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
SCHEMBL21855846 0.91 HTT (0.43) ALDH1A1KDM4ESMN1; SMN2LMNAHTT
SCHEMBL21855938 0.78 KDM4E (0.38) KDM4ELMNAHTTMKNK1MAPK1
SCHEMBL2067267 0.78 PGK1 (0.35) UTS2RLMNA
SCHEMBL16506402 0.76 UTS2R (0.44) UTS2RALDH1A1KDM4ESMN1; SMN2LDHA
SCHEMBL19641006 0.72 CLK4 (0.53) ALDH1A1KDM4EHTTNPC1RAB9A
SCHEMBL5596570 0.71 KCNH3 (0.41) UTS2RALDH1A1KDM4ESMN1; SMN2LDHA
SCHEMBL2069504 0.71
SCHEMBL21856005 0.70 UTS2R (0.46) UTS2RALDH1A1KDM4ESMN1; SMN2LDHA
SCHEMBL21856112 0.70 UTS2R (0.46) UTS2RALDH1A1KDM4ESMN1; SMN2LDHA
SCHEMBL27713561 0.69 UTS2R (0.44) UTS2RALDH1A1KDM4ESMN1; SMN2LDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3867238-B1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC (US) 2023-06-07 EP claimed
CN-114341124-A Protein tyrosine phosphatase inhibitors ARRAY生物制药公司 2022-04-12 CN claimed
US-20210380582-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2021-12-09 US claimed
WO-2020081848-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2020-04-23 WO claimed
EP-3867238-B1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC (US) 2023-06-07 EP disclosed
CN-114341124-A Protein tyrosine phosphatase inhibitors ARRAY生物制药公司 2022-04-12 CN disclosed
US-20210380582-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2021-12-09 US disclosed
WO-2020081848-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2020-04-23 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 (1 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-20210380582-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS PPM1A, PTP4A1, PPP5C UTS2R 2056/4885ALDH1A1 1775/4885KDM4E 1572/4885

“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.