SCHEMBL13226849

SCHEMBL13226849

CCC1Sc2ccc(Cl)cc2C1C=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 3/20 0.34
▸ FNTB P49356 3/20 0.34
▸ PGGT1B P53609 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ HTR2C P28335 4/20 0.32
▸ HTR2A P28223 2/20 0.32
▸ HTR2B P41595 2/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ IDO1 P14902 1/20 0.31
▸ DRD2 P14416 3/20 0.31
▸ HRH1 P35367 3/20 0.31
▸ DRD4 P21917 2/20 0.31
▸ KCNK9 Q9NPC2 2/20 0.31
▸ TP53 P04637 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ NFKB1 P19838 1/20 0.31

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
SCHEMBL28696340 0.68 VHL (0.34) RAB9ALMNAMAPTTDP1
SCHEMBL13535017 0.67 VHL (0.36) IDO1NPC1MEN1LMNAMAPT
SCHEMBL11471692 0.64 CACNB4 (0.47) HTR2CHTR2AHTR2BDRD2HRH1
SCHEMBL28166968 0.64 DRD2 (0.44) PGRHTR2CDRD2HRH1DRD4
1,4-Dichlorobenzene SCHEMBL27455358 0.63 MAPK1 (0.53) IDO1CYP3A4TSHRLMNATDP1
SCHEMBL13812102 0.63 IDO1 (0.42) HTR2CHTR2AHTR2BIDO1DRD2
Hydrochloric Acid SCHEMBL11474191 0.63 CACNB4 (0.46) TP53CYP1A2TSHRCYP2C19MAPT
SCHEMBL18748423 0.62 S100A4 (0.41) HTR2BTP53CYP1A2MEN1MAPT
SCHEMBL14781250 0.61 HTR2C (0.44) HTR2CHTR2AHTR2BDRD2HRH1
Propionaldehyde SCHEMBL27792856 0.61 CHRM2 (0.44) CYP1A2TSHRKMT2ATDP1

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-20100197657-A1 2-ARYL OR HETEROARYL INDOLE DERIVATIVES CHANG RONALD K 2010-08-05 — — 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-20100197657-A1 2-ARYL OR HETEROARYL INDOLE DERIVATIVES ASIC1, ASIC3, TRPV1 FNTA 3156/4885FNTB 3632/4885PGGT1B 1526/4885

“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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