SCHEMBL5236263

SCHEMBL5236263

CS(=O)(=O)OCCSc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.52
MAPK1 P28482 1/20 0.52
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
TSHR P16473 2/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
MMP9 P14780 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
GAA P10253 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL6042192 0.89 ALDH1A1 (0.49) ALDH1A1MAPK1MTNR1AMTNR1BTSHR
SCHEMBL23015062 0.86 ALDH1A1 (0.50) ALDH1A1MAPK1MTNR1AMTNR1BTSHR
SCHEMBL9647380 0.84 ALDH1A1 (0.56) ALDH1A1MAPK1MTNR1AMTNR1BTSHR
SCHEMBL4614675 0.81 ALDH1A1 (0.39) ALDH1A1MAPK1TSHRLMNAKDM4E
SCHEMBL25986916 0.81 ALDH1A1 (0.52) ALDH1A1MAPK1MTNR1AMTNR1BTSHR
SCHEMBL10744128 0.75 KIF11 (0.54)
SCHEMBL1025612 0.73 ALDH1A1 (0.64) ALDH1A1MAPK1MTNR1AMTNR1BTSHR
SCHEMBL6589802 0.72 CA1 (0.66) ALDH1A1TSHRLMNAKDM4EUSP2
SCHEMBL16586149 0.72 ALDH1A1 (0.70) ALDH1A1MAPK1MTNR1AMTNR1BKDM4E
SCHEMBL7917142 0.72 ALDH1A1 (0.50) ALDH1A1MAPK1MTNR1AMTNR1BTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260078123-A1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVE, AND PREPARATION METHOD AND USE THEREOF SHANGHAI DAIDAI INVESTMENT CONSULTING CO., LTD (CN) 2026-03-19 US disclosed
US-12516054-B2 Pyrazolo[1,5-a]pyridine derivatives, preparation method therefor and use thereof SHANGHAI DAIDAI INVESTMENT CONSULTING CO., LTD (CN) 2026-01-06 US disclosed
US-20220135560-A1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF CLUES THERAPEUTICS (SHANGHAI) LTD (CN) 2022-05-05 US disclosed
US-7244722-B2 Amino-substituted 1H-pyrazin-2-ones and 1H-quinoxalin-2-ones BIOVITRUM AB (SE) 2007-07-17 US disclosed
EP-1534391-B1 NOVEL PIPERAZINYL-PYRAZINONE DERIVATIVES FOR THE TREATMENT OF 5-HT2A RECEPTOR-RELATED DISORDERS BIOVITRUM AB (SE) 2007-02-14 EP disclosed
EP-1534391-A1 NOVEL PIPERAZINYL-PYRAZINONE DERIVATIVES FOR THE TREATMENT OF 5-HT2A RECEPTOR-RELATED DISORDERS Biovitrum AB (SE) 2005-06-01 EP disclosed
US-20040063693-A1 Compounds BIOVITRUM AB (SE) 2004-04-01 US disclosed
WO-2004009586-A1 NOVEL PIPERAZINYL-PYRAZINONE DERIVATIVES FOR THE TREATMENT OF 5-HT2A RECEPTOR-RELATED DISORDERS BIOVITRUM AB (SE) 2004-01-29 WO disclosed
US-3993768-A FUNGICIDES SYNTEX (U.S.A.) INC. (US) 1976-11-23 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 (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-20260078123-A1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVE, AND PREPARATION METHOD AND USE THEREOF NR3C1, CXCR1, CCR1 ALDH1A1 2581/4885MAPK1 699/4885MTNR1A 506/4885
US-20040063693-A1 Compounds HTR1A, HTR1B, HTR2C ALDH1A1 412/4885MAPK1 2145/4885MTNR1A 37/4885
US-20220135560-A1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF RET, RIN1, WEE1 ALDH1A1 1030/4885MAPK1 46/4885MTNR1A 3263/4885

“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.