SCHEMBL19705331

SCHEMBL19705331

CC(C)c1cccc2c1OCCCN2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.35
GABRA1 P14867 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
FAAH O00519 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
GABRB1 P18505 1/20 0.33
PTGS1 P23219 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2C P28335 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
HTR2B P41595 1/20 0.33
GABRA2 P47869 1/20 0.33

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
SCHEMBL69988 0.90 TAAR1 (0.40) TAAR1GABRA1GABRG2GABRB3FAAH
SCHEMBL71450 0.80 GABRA1 (0.38) TAAR1GABRA1GABRG2GABRB3FAAH
SCHEMBL19746612 0.78 BRD4 (0.36) TAAR1HTR2CHTR1ADRD2ADRA2A
SCHEMBL2599670 0.75 ADORA2A (0.37) HTR2CHTR1ADRD2ADRA2A
SCHEMBL4467397 0.75 ADRA2A (0.35) HTR2BHTR1ADRD2ADRA2AADRA2B
SCHEMBL19744425 0.74 LMNA (0.36) CA1CA2LMNASLC6A2ADRA2A
SCHEMBL12180456 0.73 GABRA1 (0.38) GABRA1GABRG2GABRB3FAAHCA1
SCHEMBL27051273 0.72 CREBBP (0.38) HTR1ADRD2
SCHEMBL7726891 0.71 GRIA1 (0.38) TAAR1GABRA1GABRG2GABRB3FAAH
SCHEMBL13532967 0.71 PARP1 (0.38) TAAR1GABRA1GABRG2GABRB3FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11053197-B2 Carbazole derivatives BRISTOL-MYERS SQUIBB COMPANY (US) 2021-07-06 US disclosed
US-20200255377-A1 CARBAZOLE DERIVATIVES Organization Name: BRISTOL-MYERS SQUIBB COMPANY (US) 2020-08-13 US disclosed
US-10676434-B2 Carbazole derivatives BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-09 US disclosed
US-20190225583-A1 CARBAZOLE DERIVATIVES BRISTOL MYERS SQUIBB CO (US) 2019-07-25 US disclosed
US-10266491-B2 Carbazole derivatives BRISTOL-MYERS SQUIBB COMPANY (US) 2019-04-23 US disclosed
US-10023534-B2 Carbazole and tetrahydrocarbazole compounds useful as inhibitors of BTK BRISTOL-MYERS SQUIBB COMPANY (US) 2018-07-17 US disclosed
US-20170362176-A1 CARBAZOLE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 2017-12-21 US disclosed
US-20170355673-A1 TRICYCLIC ATROPISOMER COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2017-12-14 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 (8 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-20170355673-A1 TRICYCLIC ATROPISOMER COMPOUNDS BTK, LCK, SYK TAAR1 1373/4885GABRA1 1281/4885GABRG2 1822/4885
US-10266491-B2 Carbazole derivatives BTK, SYK, JAK2 TAAR1 2731/4885GABRA1 1512/4885GABRG2 2041/4885
US-10676434-B2 Carbazole derivatives BTK, SYK, JAK2 TAAR1 2732/4885GABRA1 1533/4885GABRG2 2119/4885
US-20170362176-A1 CARBAZOLE DERIVATIVES BTK, SYK, JAK2 TAAR1 2731/4885GABRA1 1512/4885GABRG2 2041/4885
US-11053197-B2 Carbazole derivatives BTK, SYK, JAK2 TAAR1 2732/4885GABRA1 1533/4885GABRG2 2119/4885
US-20190225583-A1 CARBAZOLE DERIVATIVES BTK, SYK, JAK2 TAAR1 2732/4885GABRA1 1533/4885GABRG2 2119/4885
US-10023534-B2 Carbazole and tetrahydrocarbazole compounds useful as inhibitors of BTK BTK, JAK2, SYK TAAR1 2966/4885GABRA1 774/4885GABRG2 1271/4885
US-20200255377-A1 CARBAZOLE DERIVATIVES BTK, SYK, JAK2 TAAR1 2732/4885GABRA1 1533/4885GABRG2 2119/4885

“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.