SCHEMBL23924367

SCHEMBL23924367

O=C(c1cccc2cnccc12)C1CN(Cc2ccccc2)CC1c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.51
ROCK2 O75116 9/20 0.47
ROCK1 Q13464 3/20 0.46
P2RX7 Q99572 4/20 0.44
CCR2 P41597 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
MC4R P32245 1/20 0.41
DRD4 P21917 1/20 0.41
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL23924365 1.00 RORC (0.51) RORCROCK2ROCK1P2RX7CCR2
SCHEMBL29900609 1.00 RORC (0.51) RORCROCK2ROCK1P2RX7CCR2
SCHEMBL23951506 1.00 RORC (0.51) RORCROCK2ROCK1P2RX7CCR2
SCHEMBL23924265 0.83 ALDH1A1 (0.41) ROCK2P2RX7
SCHEMBL23924266 0.83 ALDH1A1 (0.41) ROCK2P2RX7
SCHEMBL20139670 0.81 RORC (0.71) RORCDRD4
SCHEMBL20141807 0.81 RORC (0.71) RORCDRD4
SCHEMBL28932959 0.77 RORC (0.46) RORCP2RX7MAPT
SCHEMBL23951504 0.77 RORC (0.46) RORCP2RX7MAPT
SCHEMBL23951260 0.76 BACE1 (0.44) ROCK2P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220213061-A9 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 TES PHARMA S.R.L. (IT) 2022-07-07 US disclosed
US-20210323942-A1 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 TES PHARMA S R L (IT) 2021-10-21 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-20220213061-A9 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 NR2E3, NR2F2, NR2C2 RORC 46/4885ROCK2 2207/4885ROCK1 3857/4885
US-20210323942-A1 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 NR2E3, NR2F2, NR2C2 RORC 46/4885ROCK2 2207/4885ROCK1 3857/4885

“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.