SCHEMBL14947394

SCHEMBL14947394

COc1cc(C(=O)/C=C/C=C/c2ccccc2Cl)cc(OC)c1OC

nearest known ligand 0.81

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 6/20 0.81
▸ ABCG2 Q9UNQ0 4/20 0.64
▸ TNFRSF1A P19438 2/20 0.59
▸ CAPN1 P07384 2/20 0.56
▸ CTSL P07711 2/20 0.56
▸ CTSB P07858 2/20 0.56
▸ MAOB P27338 1/20 0.54
▸ KRAS P01116 2/20 0.52
▸ NPC1 O15118 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ GPR55 Q9Y2T6 1/20 0.51

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
SCHEMBL527372 0.90 ABCB1 (1.00) ABCB1ABCG2TNFRSF1ACAPN1CTSL
SCHEMBL14947390 0.90 ABCB1 (1.00) ABCB1ABCG2TNFRSF1ACAPN1CTSL
SCHEMBL14947392 0.83 ABCB1 (1.00) ABCB1ABCG2TNFRSF1ACAPN1CTSL
SCHEMBL527576 0.83 ABCB1 (1.00) ABCB1ABCG2TNFRSF1ACAPN1CTSL
SCHEMBL14947393 0.82 TNFRSF1A (0.82) ABCB1ABCG2TNFRSF1AKRAS
SCHEMBL14947391 0.79 ABCB1 (1.00) ABCB1CAPN1CTSLCTSBMAOB
SCHEMBL30504731 0.77 ABCG2 (0.73) ABCB1ABCG2TNFRSF1AKRASLMNA
SCHEMBL14947395 0.75 ABCB1 (0.70) ABCB1ABCG2TNFRSF1AMAOBKRAS
SCHEMBL14947399 0.75 CAPN1 (0.59) ABCB1ABCG2CAPN1CTSLCTSB
SCHEMBL12484518 0.74 TNFRSF1A (1.00) ABCB1ABCG2TNFRSF1AKRAS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130123367-A1 VINYLOGOUS CHALCONE DERIVATIVES AND THEIR MEDICAL USE MEDIZINISCHE UNIVERSITAT WIEN (AT) 2013-05-16 — — US disclosed
US-20130123367-A1 VINYLOGOUS CHALCONE DERIVATIVES AND THEIR MEDICAL USE MEDIZINISCHE UNIVERSITAT WIEN (AT) 2013-05-16 — — 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-20130123367-A1 VINYLOGOUS CHALCONE DERIVATIVES AND THEIR MEDICAL USE MALT1, VHL, ETV6 ABCB1 19/4885ABCG2 202/4885TNFRSF1A 2195/4885

“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.

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