SCHEMBL13660508

SCHEMBL13660508

CCc1ccc(CNCc2cccc(C(=O)O)c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 5/20 0.60
SMN1; SMN2 Q16637 2/20 0.59
MYC P01106 1/20 0.59
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
ALDH1A1 P00352 1/20 0.53
FOLH1 Q04609 1/20 0.51
NR1H4 Q96RI1 1/20 0.51
FNTA P49354 1/20 0.50
FNTB P49356 1/20 0.50
PGGT1B P53609 1/20 0.50
S1PR5 Q9H228 1/20 0.49
MRGPRX4 Q96LA9 1/20 0.49
HIF1A Q16665 1/20 0.49
BCL2 P10415 1/20 0.49

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
SCHEMBL25942433 0.86 MEP1B (0.61) MEP1BSMN1; SMN2MYCCA1CA2
SCHEMBL16366609 0.85 MEP1B (0.65) MEP1BSMN1; SMN2MYCCA1CA2
SCHEMBL30444148 0.85 MEP1B (0.65) MEP1BSMN1; SMN2MYCCA1CA2
SCHEMBL46935 0.83 BCL2 (0.66) SMN1; SMN2ALDH1A1FOLH1MRGPRX4HIF1A
SCHEMBL30394310 0.83 BCL2 (0.66) SMN1; SMN2ALDH1A1FOLH1MRGPRX4HIF1A
SCHEMBL6916420 0.81 BCL2 (0.64) SMN1; SMN2ALDH1A1FOLH1MRGPRX4HIF1A
SCHEMBL6917284 0.81 BCL2 (0.64) SMN1; SMN2ALDH1A1FOLH1MRGPRX4HIF1A
Ammonia Solution, Strong SCHEMBL22042022 0.81 BCL2 (0.64) SMN1; SMN2ALDH1A1FOLH1MRGPRX4HIF1A
SCHEMBL6909307 0.81 BCL2 (0.64) SMN1; SMN2ALDH1A1FOLH1MRGPRX4HIF1A
SCHEMBL6916326 0.81 BCL2 (0.64) SMN1; SMN2ALDH1A1FOLH1MRGPRX4HIF1A

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-9574189-B2 Enzymatic encoding methods for efficient synthesis of large libraries NUEVOLUTION A/S (DK) 2017-02-21 US disclosed
US-9574189-B2 Enzymatic encoding methods for efficient synthesis of large libraries NUEVOLUTION A/S (DK) 2017-02-21 US disclosed
US-20090264300-A1 ENZYMATIC ENCODING METHODS FOR EFFICIENT SYNTHESIS OF LARGE LIBRARIES NUEVOLUTION A/S (DK) 2009-10-22 US disclosed
US-20090264300-A1 ENZYMATIC ENCODING METHODS FOR EFFICIENT SYNTHESIS OF LARGE LIBRARIES NUEVOLUTION A/S (DK) 2009-10-22 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-20090264300-A1 ENZYMATIC ENCODING METHODS FOR EFFICIENT SYNTHESIS OF LARGE LIBRARIES RNGTT, DUT, EMG1 MEP1B 1117/4885SMN1; SMN2 3626/4885MYC 1255/4885

“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.