SCHEMBL6435655

SCHEMBL6435655

O=C(O)C1(c2ccccc2)COCCO1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.39
ALDH1A1 P00352 4/20 0.39
HTR1A P08908 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 2/20 0.36
LMNA P02545 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
LDHA P00338 1/20 0.35
GAA P10253 1/20 0.35
CHRM2 P08172 3/20 0.35
CHRM4 P08173 3/20 0.35
CHRM5 P08912 3/20 0.35
CHRM1 P11229 3/20 0.35
CHRM3 P20309 3/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RAB9A P51151 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL4637662 0.85 AKR1C1 (0.47) AKR1C1ALDH1A1TSHRLMNALDHA
SCHEMBL4637584 0.85 AKR1C1 (0.47) AKR1C1ALDH1A1TSHRLMNALDHA
SCHEMBL487380 0.85 AKR1C1 (0.47) AKR1C1ALDH1A1TSHRLMNALDHA
SCHEMBL5665997 0.84 AKR1C1 (0.40) AKR1C1ALDH1A1SMN1; SMN2TSHRLMNA
Ammonia Solution, Strong SCHEMBL6650400 0.83 AKR1C1 (0.45) AKR1C1ALDH1A1TSHRLMNALDHA
SCHEMBL11303680 0.79 OPRM1 (0.47) ALDH1A1SMN1; SMN2NPSR1GAAOPRM1
SCHEMBL4829823 0.76 AKR1C1 (0.48) AKR1C1ALDH1A1SMN1; SMN2TSHRLMNA
SCHEMBL10848298 0.75 AKR1C1 (0.52) AKR1C1ALDH1A1SMN1; SMN2TSHRLMNA
SCHEMBL29240149 0.72 HTR2A (0.41) AKR1C1ALDH1A1TSHRLMNALDHA
Potassium Ion SCHEMBL11295824 0.72 AKR1C1 (0.38) AKR1C1SMN1; SMN2TSHRLMNALDHA

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
EP-1085909-B1 A complex of alpha-fetoprotein (AFP) and a polyunsaturated fatty acid derivative for the treatment of immune deficiencies ARDENIA INVESTMENTS LTD (GI) 2005-12-28 EP disclosed
US-6599507-B2 Immunostimulation ARDENIA INVESTMENTS, LTD. (GI) 2003-07-29 US disclosed
US-20010034324-A1 Composition for the treatment of immune deficiencies and methods for its preparation and use OASMIA PHARMACEUTICAL AB (SE) 2001-10-25 US disclosed
EP-1085909-A2 COMPOSITION FOR THE TREATEMENT OF IMMUNE DEFICIENCIES AND METHODS FOR ITS PREPARATION AND USE Ardenia Investments Ltd. (GI) 2001-03-28 EP disclosed
WO-1999065936-A2 COMPOSITION FOR THE TREATEMENT OF IMMUNE DEFICIENCIES AND METHODS FOR ITS PREPARATION AND USE ARDENIA INVESTMENTS LTD. (GI) 1999-12-23 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 (1 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-20010034324-A1 Composition for the treatment of immune deficiencies and methods for its preparation and use ALB, NAPEPLD, TTPA AKR1C1 3429/4885ALDH1A1 2119/4885HTR1A 4653/4885

“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.