SCHEMBL16018015

SCHEMBL16018015

C=C(C)c1c(C)cc(OC)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.49
USP2 O75604 1/20 0.49
MAPK1 P28482 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HPGD P15428 2/20 0.43
KMT2A Q03164 2/20 0.41
ABCG2 Q9UNQ0 1/20 0.40
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
POLB P06746 1/20 0.38
ABL1 P00519 1/20 0.38
BCR P11274 1/20 0.38
NQO2 P16083 2/20 0.38
CYP19A1 P11511 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 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
SCHEMBL24146231 0.88 CYP3A4 (0.48) CYP3A4USP2MAPK1SMN1; SMN2HPGD
SCHEMBL16617843 0.88 CYP3A4 (0.55) CYP3A4USP2MAPK1SMN1; SMN2KMT2A
SCHEMBL16018016 0.81 CYP3A4 (0.68) CYP3A4USP2MAPK1SMN1; SMN2HPGD
SCHEMBL24737164 0.81 CYP3A4 (0.68) CYP3A4USP2MAPK1SMN1; SMN2HPGD
SCHEMBL311761 0.77 KMT2A (0.57) CYP3A4USP2MAPK1SMN1; SMN2HPGD
SCHEMBL347917 0.76 CYP3A4 (0.51) CYP3A4USP2MAPK1SMN1; SMN2HPGD
SCHEMBL2027170 0.76 CYP3A4 (0.69) CYP3A4USP2MAPK1SMN1; SMN2HPGD
SCHEMBL9956291 0.76 CYP3A4 (0.51) CYP3A4USP2MAPK1SMN1; SMN2HPGD
SCHEMBL347495 0.73 CYP3A4 (0.51) CYP3A4USP2MAPK1SMN1; SMN2HPGD
SCHEMBL18511828 0.73 CYP3A4 (0.51) CYP3A4USP2MAPK1SMN1; SMN2HPGD

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-20160000669-A1 RESORCINOL COMPOUNDS FOR DERMATOLOGICAL USE CONOPCO, INC., D/B/A UNILEVER (US) 2016-01-07 US disclosed
US-20140256830-A1 RESORCINOL COMPOUNDS FOR DERMATOLOGICAL USE UNILEVER N.V. (NL) 2014-09-11 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 (2 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-20160000669-A1 RESORCINOL COMPOUNDS FOR DERMATOLOGICAL USE NQO1, RBP4, KEAP1 CYP3A4 1742/4885USP2 974/4885MAPK1 2819/4885
US-20140256830-A1 RESORCINOL COMPOUNDS FOR DERMATOLOGICAL USE NQO1, RBP4, KEAP1 CYP3A4 1742/4885USP2 974/4885MAPK1 2819/4885

“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.