SCHEMBL17492955

SCHEMBL17492955

COc1c(O)c(O)c(O)c2c1C(=O)c1cc3ccccc3cc1C2=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.48
▸ MAPT P10636 5/20 0.46
▸ ALDH1A1 P00352 4/20 0.46
▸ LCK P06239 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ LIMK1 P53667 1/20 0.46
▸ LIMK2 P53671 1/20 0.46
▸ RAB9A P51151 3/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ KDM4E B2RXH2 3/20 0.44
▸ TDP1 Q9NUW8 3/20 0.44
▸ MAOA P21397 3/20 0.44
▸ CYP3A4 P08684 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ ALOX15 P16050 2/20 0.44
▸ TTR P02766 1/20 0.44
▸ CYP1A1 P04798 1/20 0.44

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
Hydrochloric Acid SCHEMBL1488003 0.98 PIM1 (0.47) PIM1MAPTALDH1A1LCKGLA
SCHEMBL28656542 0.80 PDE4A (0.55) PIM1MAPTALDH1A1LCKGLA
SCHEMBL4440142 0.79 PIM1 (0.39) PIM1MAPTALDH1A1LCKGLA
SCHEMBL19478231 0.78 MAPT (0.56) MAPTALDH1A1LCKGLATHRB
Hydrochloric Acid SCHEMBL2461009 0.77 RAB9A (0.53) PIM1MAPTALDH1A1LCKGLA
SCHEMBL15649811 0.77 PIM1 (0.47) PIM1MAPTALDH1A1LCKGLA
SCHEMBL10865211 0.75 MAPT (0.67) MAPTALDH1A1RAB9AMEN1KMT2A
SCHEMBL1149730 0.74 MAPT (0.66) PIM1MAPTALDH1A1LCKGLA
SCHEMBL8341400 0.73 MAPT (0.69) MAPTALDH1A1LCKGLATHRB
SCHEMBL19461410 0.72 MAPT (0.61) PIM1MAPTALDH1A1LCKGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124419-A1 SMALL MOLECULE INHIBITORS OF GRP78 AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2024-04-18 — — US disclosed
US-20230364084-A1 METHODS FOR PREVENTING OR TREATING CONDITIONS RELATED TO PIKFYVE ACTIVITY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-11-16 — — US disclosed
US-20170119880-A1 COMPOSITIONS AND METHODS FOR CHARACTERIZING, REGULATING, DIAGNOSING, AND TREATING CANCER NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-05-04 — — US disclosed
US-20160040163-A1 DNAI FOR THE MODULATION OF GENES PRONAI THERAPEUTICS INC (US) 2016-02-11 — — 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 (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-20240124419-A1 SMALL MOLECULE INHIBITORS OF GRP78 AND USES THEREOF HSPA5, HSPA2, PSMG3 PIM1 145/4885MAPT 1678/4885ALDH1A1 2525/4885
US-20230364084-A1 METHODS FOR PREVENTING OR TREATING CONDITIONS RELATED TO PIKFYVE ACTIVITY PIKFYVE, PPME1, MTMR1 PIM1 3240/4885MAPT 2421/4885ALDH1A1 4574/4885

“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