SCHEMBL3266069

SCHEMBL3266069

c1cnc2ccc(OCC3CO3)cc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
TP53 P04637 4/20 0.57
TSHR P16473 4/20 0.57
HIF1A Q16665 2/20 0.57
CYP3A4 P08684 2/20 0.57
TDP1 Q9NUW8 1/20 0.50
FGFR1 P11362 1/20 0.48
SRC P12931 1/20 0.48
RAB9A P51151 4/20 0.47
MAPT P10636 6/20 0.46
NPC1 O15118 2/20 0.46
HTT P42858 2/20 0.46
NR2F2 P24468 1/20 0.46
MAPK1 P28482 1/20 0.46
POLB P06746 1/20 0.45
LMNA P02545 3/20 0.44
HPGD P15428 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 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
SCHEMBL3266066 1.00 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2TP53TSHRHIF1A
SCHEMBL7964323 1.00 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2TP53TSHRHIF1A
SCHEMBL7966245 0.88 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2TP53TSHRHIF1A
SCHEMBL7966244 0.88 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2TP53TSHRHIF1A
SCHEMBL7966243 0.88 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2TP53TSHRHIF1A
SCHEMBL10366380 0.84 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2TP53TSHRRAB9A
SCHEMBL10368025 0.82 RAB9A (0.47) ALDH1A1SMN1; SMN2RAB9AMAPTNPC1
SCHEMBL844653 0.81 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2TP53TSHRHIF1A
SCHEMBL30546900 0.81 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2TP53TSHRHIF1A
SCHEMBL4620895 0.81 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2TP53TSHRHIF1A

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025078654-A1 ANTIBACTERIAL COMPOUNDS VEIRULENCE LTD (GB) 2025-04-17 WO disclosed
EP-1326833-B1 SUBSTITUTED HETEROCYCLIC COMPOUNDS FOR TREATING MULTIDRUG RESISTANCE H LEE MOFFITT CANCER CT & RES (US) 2010-06-02 EP disclosed
US-7476680-B2 Substituted heterocyclic compounds for treating multidrug resistance H. LEE MOFFITT CANCER CENTER & RESEARCH INSTITUTE, INC. (US) 2009-01-13 US disclosed
EP-1339701-B1 HETEROARYL ALKYL PIPERAZINE DERIVATIVES AS FATTY ACID OXIDATION INHIBITORS CV THERAPEUTICS INC (US) 2007-02-14 EP disclosed
US-7135483-B2 Substituted heterocyclic compounds for treating multidrug resistance H. LEE MOFFITT CANCER CENTER & RESEARCH INSTITUTE, INC. (US) 2006-11-14 US disclosed
US-20060223853-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS FOR TREATING MULTIDRUG RESISTANCE H. LEE MOFFITT CANCER CENTER & RESEARCH INSTITUTE, INC. (US) 2006-10-05 US disclosed
US-6849632-B2 Heteroaryl alkyl piperazine derivatives CV THERAPEUTICS, INC. (US) 2005-02-01 US disclosed
US-20040192702-A1 Heteroaryl alkyl piperazine derivatives ZABLOCKI JEFF (US) 2004-09-30 US disclosed
US-20040029889-A1 Heteroaryl alkyl piperazine derivatives as fatty acid oxidation inhibitors CV THERAPEUTICS, INC. 2004-02-12 US disclosed
US-20030216409-A1 Heteroaryl alkyl piperazine derivatives CV THERAPEUTICS, INC. 2003-11-20 US disclosed
US-6573264-B1 Protecting skeletal muscles against damage, treating shock conditions, preserving donor tissue and organs used in transplants, treating cardiovascular diseases CV THERAPEUTICS, INC. 2003-06-03 US disclosed
WO-2002064576-A1 HETEROARYL ALKYL PIPERAZINE DERIVATIVES AS FATTY ACID OXIDATION INHIBITORS CV THERAPEUTICS, INC. (US) 2002-08-22 WO disclosed
US-20020099215-A1 Substituted heterocyclic compounds for treating multidrug resistance THE PROCTER GAMBLE CO. 2002-07-25 US disclosed
WO-2002032869-A2 SUBSTITUTED HETEROCYCLIC COMPOUNDS FOR TREATING MULTIDRUG RESISTANCE THE PROCTER & GAMBLE COMPANY (US) 2002-04-25 WO disclosed
US-6376514-B1 PIPERIDINE-DERIVED COMPOUNDS CONTAINING A QUINOLYL GROUP THAT INHIBITS P-GLYCOPROTEIN TRANSPORT PROTEIN ACTIVITY; FOR TREATING CANCER AND OTHER DISEASES THE PROCTER & GAMBLE CO. 2002-04-23 US disclosed
US-6242450-B1 SUBSTITUTED PIPERIDINES ELI LILLY AND COMPANY 2001-06-05 US disclosed
WO-2000006082-A2 TREATMENT OF ANXIETY DISORDERS ELI LILLY AND COMPANY (US) 2000-02-10 WO disclosed
WO-2000006166-A1 5-HT1F ANTAGONISTS ELI LILLY AND COMPANY (US) 2000-02-10 WO disclosed
EP-0976746-A1 5-HT1F antagonists ELI LILLY AND COMPANY (US) 2000-02-02 EP disclosed
EP-0976747-A2 Use of 5HT-1F receptor antagonists for treating anxiety disorders ELI LILLY AND COMPANY (US) 2000-02-02 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 (5 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-20060223853-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS FOR TREATING MULTIDRUG RESISTANCE ABCC1, ABCB1, ABCB11 ALDH1A1 540/4885SMN1; SMN2 2454/4885TP53 2268/4885
US-20040029889-A1 Heteroaryl alkyl piperazine derivatives as fatty acid oxidation inhibitors CPT1B, CPT1A, ALOX15 ALDH1A1 69/4885SMN1; SMN2 1222/4885TP53 4482/4885
US-20040192702-A1 Heteroaryl alkyl piperazine derivatives ATP2A1, CPT1B, ATP2A3 ALDH1A1 110/4885SMN1; SMN2 1073/4885TP53 3711/4885
US-20020099215-A1 Substituted heterocyclic compounds for treating multidrug resistance ABCC1, ABCB1, ABCB11 ALDH1A1 351/4885SMN1; SMN2 2929/4885TP53 1486/4885
US-20030216409-A1 Heteroaryl alkyl piperazine derivatives ATP2A1, CPT1B, ATP2A3 ALDH1A1 110/4885SMN1; SMN2 1073/4885TP53 3711/4885

“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.