SCHEMBL24453569

SCHEMBL24453569

CCc1ccc(-c2cc(OC)cc(OC)c2)nc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 1/20 0.52
▸ SENP8 Q96LD8 1/20 0.52
▸ SENP7 Q9BQF6 1/20 0.52
▸ SENP6 Q9GZR1 1/20 0.52
▸ RAB9A P51151 3/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ CYP11B1 P15538 2/20 0.49
▸ CYP11B2 P19099 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ CYP1B1 Q16678 4/20 0.49
▸ CYP1A1 P04798 3/20 0.49
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2E1 P05181 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C8 P10632 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2A6 P11509 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP4B1 P13584 1/20 0.46
▸ CYP2B6 P20813 1/20 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
SCHEMBL15304189 0.86 KDM1A (0.54) CASP3SENP8SENP7SENP6RAB9A
SCHEMBL22454022 0.77 NPC1 (0.56) RAB9ANPC1SMN1; SMN2CYP1B1CYP1A1
SCHEMBL14083011 0.76 NPC1 (0.55) RAB9ANPC1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL803150 0.76 RAB9A (0.69) CASP3SENP8SENP7SENP6RAB9A
SCHEMBL30516644 0.76 KDM1A (0.55) CASP3SENP8SENP7SENP6RAB9A
SCHEMBL25367014 0.76 KDM1A (0.55) CASP3SENP8SENP7SENP6RAB9A
SCHEMBL15060593 0.76 RAB9A (0.51) CASP3SENP8SENP7SENP6RAB9A
SCHEMBL7563886 0.75 RAB9A (0.56) CASP3SENP8SENP7SENP6RAB9A
SCHEMBL31280939 0.75 RAB9A (0.56) CASP3SENP8SENP7SENP6RAB9A
SCHEMBL9327060 0.74 CYP11B1 (0.52) CASP3SENP8SENP7SENP6RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220162186-A1 PROSTAGLANDIN RECEPTOR EP2 ANTAGONISTS, DERIVATIVES, AND USES RELATED THERETO EMORY UNIVERSITY 2022-05-26 — — 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 (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-20220162186-A1 PROSTAGLANDIN RECEPTOR EP2 ANTAGONISTS, DERIVATIVES, AND USES RELATED THERETO PTGER2, PTGES2, PTGES CASP3 1389/4885SENP8 2713/4885SENP7 3287/4885

“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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