SCHEMBL16762252

SCHEMBL16762252

O=C1NC(=S)S/C1=C\c1ccc2oc3ccccc3c2c1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 3/20 0.61
▸ MEN1 O00255 2/20 0.61
▸ RAB9A P51151 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ NAT1 P18440 7/20 0.58
▸ CA2 P00918 1/20 0.58
▸ EPHX1 P07099 1/20 0.58
▸ MYC P01106 1/20 0.55
▸ MAX P61244 1/20 0.55
▸ PDE4B Q07343 1/20 0.55
▸ PDE3A Q14432 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ CISD1 Q9NZ45 1/20 0.54
▸ MMP3 P08254 2/20 0.53
▸ MMP13 P45452 2/20 0.53

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
SCHEMBL16762257 1.00 PIM1 (0.61) PIM1MEN1RAB9AKMT2ANAT1
SCHEMBL16762254 1.00 PIM1 (0.61) PIM1MEN1RAB9AKMT2ANAT1
SCHEMBL16762221 0.85 XDH (0.53) PIM1MEN1RAB9AKMT2ACISD1
SCHEMBL16762223 0.85 XDH (0.53) PIM1MEN1RAB9AKMT2ACISD1
SCHEMBL16998370 0.80 RAB9A (0.37) PIM1MEN1RAB9AKMT2ANAT1
SCHEMBL16787484 0.77 MEN1 (0.59) MEN1KMT2AALDH1A1MAPT
SCHEMBL16987573 0.77 MEN1 (0.59) MEN1KMT2AALDH1A1MAPT
SCHEMBL16987574 0.77 MEN1 (0.59) MEN1KMT2AALDH1A1MAPT
SCHEMBL1250382 0.76 PIM1 (1.00) PIM1MEN1RAB9AKMT2ANAT1
SCHEMBL1250384 0.76 PIM1 (1.00) PIM1MEN1RAB9AKMT2ANAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022255411-A1 METHOD FOR ENHANCING INNATE IMMUNE RESPONSE 国立大学法人京都大学 2022-12-08 — — WO disclosed
EP-2881397-B1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR UNIV KYOTO (JP) 2020-09-02 — — EP disclosed
EP-2881397-B1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR UNIV KYOTO (JP) 2020-09-02 — — EP disclosed
US-10017524-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor KYOTO UNIVERSITY (JP) 2018-07-10 — — US disclosed
US-10017524-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor KYOTO UNIVERSITY (JP) 2018-07-10 — — US disclosed
US-10017524-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor KYOTO UNIVERSITY (JP) 2018-07-10 — — US disclosed
US-20170355715-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2017-12-14 — — US disclosed
US-20170355715-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2017-12-14 — — US disclosed
US-20170355715-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2017-12-14 — — US disclosed
US-9745323-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor KYOTO UNIVERSITY (JP) 2017-08-29 — — US disclosed
US-9745323-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor KYOTO UNIVERSITY (JP) 2017-08-29 — — US disclosed
US-9745323-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor KYOTO UNIVERSITY (JP) 2017-08-29 — — US disclosed
US-20150225421-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2015-08-13 — — US disclosed
US-20150225421-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2015-08-13 — — US disclosed
US-20150225421-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2015-08-13 — — US disclosed
EP-2881397-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR Kyoto University (JP) 2015-06-10 — — EP disclosed
EP-2881397-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR Kyoto University (JP) 2015-06-10 — — EP 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-20150225421-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR VHL, TP53, COMT PIM1 1202/4885MEN1 31/4885RAB9A 2200/4885
US-20170355715-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR VHL, TP53, COMT PIM1 1202/4885MEN1 31/4885RAB9A 2200/4885
US-10017524-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor VHL, TP53, COMT PIM1 1202/4885MEN1 31/4885RAB9A 2200/4885

“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.

Send feedback