SCHEMBL24010071

SCHEMBL24010071

CSc1cccc([C@@H](C)O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 2/20 0.44
SLC6A2 P23975 2/20 0.44
SLC6A4 P31645 2/20 0.44
SLC6A3 Q01959 2/20 0.44
KCNH2 Q12809 1/20 0.44
UGT2B7 P16662 1/20 0.44
AKR1C3 P42330 4/20 0.40
AKR1C2 P52895 4/20 0.40
MAPT P10636 3/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
BRD4 O60885 1/20 0.39
BRD2 P25440 1/20 0.39
CREBBP Q92793 1/20 0.39

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
SCHEMBL30400846 1.00 MEN1 (0.44) MEN1KMT2ACYP3A4CYP2D6SLC6A2
SCHEMBL32683607 1.00 MEN1 (0.44) MEN1KMT2ACYP3A4CYP2D6SLC6A2
SCHEMBL30402973 1.00 MEN1 (0.44) MEN1KMT2ACYP3A4CYP2D6SLC6A2
SCHEMBL28762451 1.00 MEN1 (0.44) MEN1KMT2ACYP3A4CYP2D6SLC6A2
SCHEMBL683932 0.83 CYP3A4 (0.44) MEN1KMT2ACYP3A4CYP2D6SLC6A2
SCHEMBL6569279 0.81 SLC6A2 (0.41) MEN1KMT2ACYP3A4CYP2D6SLC6A2
SCHEMBL19122418 0.81 AKR1C3 (0.41) MEN1KMT2ACYP3A4CYP2D6SLC6A2
SCHEMBL2812852 0.79 UGT2B7 (0.56) MEN1KMT2ACYP3A4UGT2B7MAPT
SCHEMBL9331659 0.79 UGT2B7 (0.56) MEN1KMT2ACYP3A4UGT2B7MAPT
SCHEMBL9334664 0.79 UGT2B7 (0.56) MEN1KMT2ACYP3A4UGT2B7MAPT

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
US-11780849-B2 Imino sulfanone inhibitors of ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
US-11780849-B2 Imino sulfanone inhibitors of ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
CN-115996912-A Iminothiolanone inhibitors of ENPP1 沃拉斯查疗法公司 2023-04-21 CN disclosed
US-20230002406-A1 IMINO SULFANONE INHIBITORS OF ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2023-01-05 US disclosed
WO-2021225969-A1 IMINO SULFANONE INHIBITORS OF ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2021-11-11 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-11780849-B2 Imino sulfanone inhibitors of ENPP1 ENPP1, ENPP3, SMPD1 MEN1 1249/4885KMT2A 4256/4885CYP3A4 3752/4885
US-20230002406-A1 IMINO SULFANONE INHIBITORS OF ENPP1 ENPP1, ENPP3, SMPD1 MEN1 1249/4885KMT2A 4256/4885CYP3A4 3752/4885

“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.