SCHEMBL439247

SCHEMBL439247

C=Cc1ccc(COc2cc(CO)cc(OCc3ccc(C=C)cc3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 1/20 0.43
HIF1A Q16665 1/20 0.42
CYP1A1 P04798 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP19A1 P11511 1/20 0.41
FFAR1 O14842 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38

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
SCHEMBL7628720 0.98 SMN1; SMN2 (0.42) SMN1; SMN2TSHRHIF1ACYP1A1CYP1A2
SCHEMBL6394555 0.89 ALDH1A1 (0.46) SMN1; SMN2HIF1ACYP1A1CYP1A2CYP19A1
SCHEMBL3241768 0.86 NPC1 (0.47) SMN1; SMN2HIF1ACYP1A2MEN1KMT2A
SCHEMBL7619064 0.83 HIF1A (0.40) SMN1; SMN2HIF1ACYP1A1CYP1A2CYP19A1
SCHEMBL2849503 0.83 CYP1A2 (0.41) SMN1; SMN2TSHRHIF1ACYP1A1CYP1A2
SCHEMBL18959614 0.81 RXRA (0.45) SMN1; SMN2HIF1ACYP1A1CYP1A2CYP19A1
SCHEMBL13242652 0.80 APP (0.54) SMN1; SMN2RAB9ANPC1CASP3SENP8
SCHEMBL6388039 0.80 APP (0.54) SMN1; SMN2RAB9ANPC1CASP3SENP8
SCHEMBL7627169 0.80 MEN1 (0.67) SMN1; SMN2TSHRHIF1AFFAR1PPARG
SCHEMBL14341693 0.78 KMT2A (0.43) SMN1; SMN2TSHRHIF1AFFAR1PPARG

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
US-9085543-B2 Polymerizable fullerene derivative and their use in organic photovoltaic cells NATIONAL CHIAO TUNG UNIVERSITY (TW) 2015-07-21 US disclosed
US-9085543-B2 Polymerizable fullerene derivative and their use in organic photovoltaic cells NATIONAL CHIAO TUNG UNIVERSITY (TW) 2015-07-21 US disclosed
US-20120060926-A1 POLYMERIZABLE FULLERENE DERIVATIVE AND THEIR USE IN ORGANIC PHOTOVOLTAIC CELLS NATIONAL CHIAO TUNG UNIVERSITY (TW) 2012-03-15 US disclosed
US-20120060926-A1 POLYMERIZABLE FULLERENE DERIVATIVE AND THEIR USE IN ORGANIC PHOTOVOLTAIC CELLS NATIONAL CHIAO TUNG UNIVERSITY (TW) 2012-03-15 US disclosed
US-6211316-B1 Taddol and titanium (IV) taddolate dendrimers NOVARTIS AG (CH) 2001-04-03 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 (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-20120060926-A1 POLYMERIZABLE FULLERENE DERIVATIVE AND THEIR USE IN ORGANIC PHOTOVOLTAIC CELLS S100A10, PIN4, ANXA4 SMN1; SMN2 4537/4885TSHR 4762/4885HIF1A 4447/4885

“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.