SCHEMBL14116366

SCHEMBL14116366

CCOC(=O)[C@H](N)Cc1c[nH]c2ccc(Br)cc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.64
GABRA1 P14867 1/20 0.55
GABRB1 P18505 1/20 0.55
GABRA3 P34903 1/20 0.55
GABRB2 P47870 1/20 0.55
TACR1 P25103 2/20 0.55
HTR2A P28223 3/20 0.52
KMT2A Q03164 3/20 0.52
KDM4E B2RXH2 2/20 0.52
LMNA P02545 2/20 0.52
HTR1A P08908 2/20 0.52
MAPT P10636 2/20 0.52
TSHR P16473 2/20 0.52
HTR2C P28335 2/20 0.52
HTR2B P41595 2/20 0.52
BLM P54132 2/20 0.52
PMP22 Q01453 2/20 0.52
ALDH1A1 P00352 1/20 0.52
CYP3A4 P08684 1/20 0.52
ADORA3 P0DMS8 1/20 0.52

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
SCHEMBL3853949 1.00 SCN9A (0.64) SCN9AGABRA1GABRB1GABRA3GABRB2
SCHEMBL5263791 1.00 SCN9A (0.64) SCN9AGABRA1GABRB1GABRA3GABRB2
Hydrochloric Acid SCHEMBL6300383 0.89 SCN9A (0.54) SCN9AGABRA1GABRB1GABRA3GABRB2
Hydrochloric Acid SCHEMBL6300382 0.89 SCN9A (0.54) SCN9AGABRA1GABRB1GABRA3GABRB2
SCHEMBL27659895 0.89 MTNR1A (0.54) SCN9AGABRA1GABRB1GABRA3GABRB2
SCHEMBL14066849 0.89 MTNR1A (0.54) SCN9AGABRA1GABRB1GABRA3GABRB2
SCHEMBL1197489 0.89 MTNR1A (0.54) SCN9AGABRA1GABRB1GABRA3GABRB2
Hydrochloric Acid SCHEMBL28558220 0.88 MTNR1A (0.53) SCN9AGABRA1GABRB1GABRA3GABRB2
Hydrochloric Acid SCHEMBL28173761 0.88 MTNR1A (0.53) SCN9AGABRA1GABRB1GABRA3GABRB2
SCHEMBL10407437 0.86 NPSR1 (0.70) SCN9ATACR1HTR2AKMT2AKDM4E

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
EP-1732543-B1 TETRACYCLIC CARBOLINE DERATIVES FOR INHIBITING ANGIOGENESIS PTC THERAPEUTICS INC (US) 2017-05-10 EP disclosed
US-8940896-B2 Tetra-cyclic carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2015-01-27 US disclosed
US-8940896-B2 Tetra-cyclic carboline derivatives useful in the inhibition of angiogenesis PTC THERAPEUTICS, INC. (US) 2015-01-27 US disclosed
US-20080182866-A1 Tetra-Cyclic Carboline Derivatives Useful in the Inhibition of Angiogenesis PTC THERAPEUTICS , INC. A CORPORATION 2008-07-31 US disclosed
US-20080182866-A1 Tetra-Cyclic Carboline Derivatives Useful in the Inhibition of Angiogenesis PTC THERAPEUTICS , INC. A CORPORATION 2008-07-31 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-20080182866-A1 Tetra-Cyclic Carboline Derivatives Useful in the Inhibition of Angiogenesis VEGFA, TEK, FLT4 SCN9A 4870/4885GABRA1 4447/4885GABRB1 3862/4885

“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.