SCHEMBL12096338

SCHEMBL12096338

COc1ccc(-c2cc[nH]n2)cc1F

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.54
ALDH1A1 P00352 5/20 0.54
RAB9A P51151 5/20 0.54
NPC1 O15118 4/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
KDM4E B2RXH2 3/20 0.49
LMNA P02545 3/20 0.49
MAPT P10636 1/20 0.49
CYP17A1 P05093 1/20 0.47
HPGD P15428 2/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
PDGFRB P09619 1/20 0.46
PDGFRA P16234 1/20 0.46
PDE4A P27815 3/20 0.45

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
SCHEMBL12096274 0.87 KDM1A (0.46) SMN1; SMN2ALDH1A1RAB9ANPC1MEN1
SCHEMBL2389958 0.84 PDE4A (0.61) SMN1; SMN2ALDH1A1RAB9ANPC1MEN1
SCHEMBL16911001 0.81 MAPT (0.51) SMN1; SMN2ALDH1A1RAB9ANPC1MEN1
SCHEMBL28052513 0.81 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1RAB9ANPC1MEN1
SCHEMBL30745584 0.80 NOTUM (0.43) ALDH1A1RAB9ANPC1KDM4ECYP17A1
SCHEMBL3103824 0.80 NOTUM (0.43) ALDH1A1RAB9ANPC1KDM4ECYP17A1
SCHEMBL8195799 0.80 KMO (0.49) SMN1; SMN2MEN1KMT2ALMNAHPGD
SCHEMBL10200382 0.80 PDE4A (0.45) SMN1; SMN2ALDH1A1RAB9ANPC1MEN1
SCHEMBL16911720 0.80 MAPT (0.54) SMN1; SMN2ALDH1A1RAB9ANPC1MEN1
SCHEMBL6774958 0.78 SCN4A (0.43) ALDH1A1MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200239427-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS AG (CH) 2020-07-30 US claimed
EP-3444242-A2 NOVEL BENZOPYRAN KINASE MODULATORS Rhizen Pharmaceuticals S.A. (CH) 2019-02-20 EP claimed
EP-3050876-A2 KINASE MODULATORS Rhizen Pharmaceuticals S.A. (CH) 2016-08-03 EP claimed
EP-2496567-A2 NOVEL BENZOPYRAN KINASE MODULATORS Rhizen Pharmaceuticals S.A. (CH) 2012-09-12 EP claimed
WO-2011055215-A2 NOVEL KINASE MODULATORS INCOZEN THERAPEUTICS PVT. LTD. (IN) 2011-05-12 WO claimed
CN-112142745-B Casein kinase 1 epsilon inhibitor, pharmaceutical composition and application thereof 杭州和正医药有限公司 2023-03-21 CN disclosed
US-11524941-B2 Pyrazole compounds as LSD1 inhibitors and applications thereof MEDSHINE DISCOVERY INC. (CN) 2022-12-13 US disclosed
CN-113968861-B Compound with PI3K delta/BTK double-target-point activity and preparation method and application thereof 杭州医学院 2022-10-21 CN disclosed
US-20220064126-A1 Pyrazole Compounds As LSD1 Inhibitors And Applications Thereof MEDSHINE DISCOVERY INC. (CN) 2022-03-03 US disclosed
CN-113968861-A Compound with PI3K delta/BTK double-target-point activity and preparation method and application thereof 杭州医学院 2022-01-25 CN 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-20220064126-A1 Pyrazole Compounds As LSD1 Inhibitors And Applications Thereof KDM1B, KDM3A, KDM1A SMN1; SMN2 2736/4885ALDH1A1 191/4885RAB9A 3109/4885
US-11524941-B2 Pyrazole compounds as LSD1 inhibitors and applications thereof KDM1B, KDM3A, KDM1A SMN1; SMN2 2736/4885ALDH1A1 191/4885RAB9A 3109/4885
US-20200239427-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB SMN1; SMN2 2637/4885ALDH1A1 4305/4885RAB9A 1297/4885

“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.