SCHEMBL14849331

SCHEMBL14849331

c1ccc2c(c1)c1ccccc1c1cc(Cn3c4ccccc4c4ccccc43)ccc21

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.64
P2RX4 Q99571 4/20 0.52
HDAC6 Q9UBN7 2/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC10 Q969S8 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
TP53 P04637 2/20 0.47
MAPT P10636 2/20 0.47
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46

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
SCHEMBL13957035 0.85 CYP19A1 (0.86) CYP19A1P2RX4HDAC6HDAC1HDAC10
SCHEMBL9128630 0.83 CYP19A1 (0.76) CYP19A1P2RX4HDAC6HDAC1HDAC10
SCHEMBL27275931 0.82 CYP19A1 (0.56) CYP19A1P2RX4TP53MAPT
SCHEMBL23371851 0.82 CYP19A1 (0.56) CYP19A1P2RX4TP53MAPT
SCHEMBL27275930 0.82 MAPT (0.68) CYP19A1TP53MAPT
SCHEMBL28758680 0.81 CYP19A1 (0.60) CYP19A1P2RX4HDAC6HDAC1HDAC10
SCHEMBL16842432 0.79 CYP19A1 (0.53) CYP19A1P2RX4HDAC6HDAC1HDAC10
SCHEMBL19155974 0.79 CYP19A1 (0.53) CYP19A1P2RX4HDAC6HDAC1HDAC10
SCHEMBL18616074 0.79 KDM4E (0.58) CYP19A1P2RX4HDAC6HDAC1HDAC10
SCHEMBL24631978 0.79 CYP19A1 (0.53) CYP19A1P2RX4HDAC6HDAC1HDAC10

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-20180006238-A1 COMPOSITION FOR ORGANIC PHOTOELECTRONIC ELEMENT, ORGANIC PHOTOELECTRONIC ELEMENT, AND DISPLAY APPARATUS SAMSUNG SDI CO., LTD. (KR) 2018-01-04 US disclosed
US-20170346025-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-11-30 US disclosed
US-8993783-B2 Compound for organic photoelectric device and organic photoelectric device including the same CHEIL INDUSTRIES, INC. (KR) 2015-03-31 US disclosed
US-20130087776-A1 COMPOUND FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME CHEIL INDUSTRIES, INC. (KR) 2013-04-11 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 (3 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-20180006238-A1 COMPOSITION FOR ORGANIC PHOTOELECTRONIC ELEMENT, ORGANIC PHOTOELECTRONIC ELEMENT, AND DISPLAY APPARATUS OCIAD2, OR51E2, PPOX CYP19A1 291/4885P2RX4 708/4885HDAC6 4381/4885
US-20170346025-A1 ORGANIC LIGHT-EMITTING DEVICE OR51E2, OR10J3, LEF1 CYP19A1 401/4885P2RX4 2149/4885HDAC6 4761/4885
US-20130087776-A1 COMPOUND FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME PPOX, PIEZO1, AOX1 CYP19A1 20/4885P2RX4 733/4885HDAC6 4850/4885

“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.