SCHEMBL19471985

SCHEMBL19471985

c1cn(Cc2ccc3c(c2)OCO3)cn1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 9/20 0.54
KDM4E B2RXH2 1/20 0.54
MAPK1 P28482 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CYP11B1 P15538 8/20 0.53
CYP11B2 P19099 7/20 0.53
CYP2A6 P11509 1/20 0.53
CYP2B6 P20813 1/20 0.53
CMA1 P23946 1/20 0.53
TBXAS1 P24557 1/20 0.51
CYP17A1 P05093 1/20 0.50

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
SCHEMBL25307651 0.85 QPCT (0.53) CYP19A1KDM4EMAPK1L3MBTL1TBXAS1
SCHEMBL28150001 0.83 CYP19A1 (0.50) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL3801428 0.81 ALDH1A1 (0.54) CYP19A1CYP11B1CYP11B2
SCHEMBL19500866 0.79 CMA1 (0.60) KDM4EMAPK1L3MBTL1CMA1
SCHEMBL9240603 0.78 QPCT (0.60) CYP19A1MAPK1
SCHEMBL23509947 0.78 LMNA (0.58) CYP19A1MAPK1L3MBTL1
SCHEMBL31307832 0.78 LMNA (0.58) CYP19A1MAPK1L3MBTL1
SCHEMBL1024261 0.76 CYP11B1 (0.84) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL11013613 0.76 CYP19A1 (0.50) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL31173984 0.76 CYP19A1 (0.61) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6

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-10435394-B2 Plant growth-promotion agent and method for promoting plant growth RIKEN (JP) 2019-10-08 US disclosed
US-10435394-B2 Plant growth-promotion agent and method for promoting plant growth RIKEN (JP) 2019-10-08 US disclosed
US-20170305886-A1 PLANT GROWTH-PROMOTION AGENT AND METHOD FOR PROMOTING PLANT GROWTH RIKEN (JP) 2017-10-26 US disclosed
US-20170305886-A1 PLANT GROWTH-PROMOTION AGENT AND METHOD FOR PROMOTING PLANT GROWTH RIKEN (JP) 2017-10-26 US disclosed
US-20170305886-A1 PLANT GROWTH-PROMOTION AGENT AND METHOD FOR PROMOTING PLANT GROWTH RIKEN (JP) 2017-10-26 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-10435394-B2 Plant growth-promotion agent and method for promoting plant growth NPR1, NAT1, NOS1 CYP19A1 742/4885KDM4E 3307/4885MAPK1 145/4885
US-20170305886-A1 PLANT GROWTH-PROMOTION AGENT AND METHOD FOR PROMOTING PLANT GROWTH NPR1, NAT1, NOS1 CYP19A1 742/4885KDM4E 3307/4885MAPK1 145/4885

“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.