SCHEMBL6318211

SCHEMBL6318211

Cc1ccc(-c2cccc(-c3ccc(C)cc3)c2N)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ACHE P22303 2/20 0.43
TDP1 Q9NUW8 2/20 0.40
ADORA2A P29274 2/20 0.39
KIT P10721 2/20 0.38
KDR P35968 2/20 0.38
FLT3 P36888 2/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ENPP1 P22413 1/20 0.38
ADORA1 P30542 1/20 0.38
POLB P06746 1/20 0.37
CD44 P16070 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ADORA3 P0DMS8 1/20 0.37

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
SCHEMBL24528368 0.93 ALDH1A1 (0.48) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL29414657 0.89 CD44 (0.48) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL2602432 0.89 CD44 (0.48) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL31010762 0.85 NPC1 (0.39) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL10464566 0.85 NPC1 (0.39) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL28367275 0.84 ALDH1A1 (0.57) ADORA2AALDH1A1ADORA1
SCHEMBL23430418 0.84 MEN1 (0.46) NPC1RAB9AMEN1KMT2ATDP1
SCHEMBL13515175 0.84 ACHE (0.48) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL28621175 0.81 NPC1 (0.47) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL9685314 0.80 ESR2 (0.44) NPC1RAB9AMEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6916893-B2 Polymerization-active transition metal complexes having bulky ligand systems SER. V. GMBH (DE) 2005-07-12 US disclosed
US-20040171774-A1 Polymerization-active transition metal complexes having bulky ligand systems RIEGER BERNHARD (DE) 2004-09-02 US disclosed
EP-1242434-B1 POLYMERIZATION-ACTIVE TRANSITION METAL COMPLEX COMPOUNDS COMPRISING A STERICALLY DEMANDING LIGAND SYSTEM SER V GMBH (DE) 2004-06-02 EP disclosed
EP-1398330-A2 Transition metal complexes having a bulky ligand system used in polymerisation Ser.V. GmbH (DE) 2004-03-17 EP 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-20040171774-A1 Polymerization-active transition metal complexes having bulky ligand systems AP1M1, CCNC, CLTB NPC1 2492/4885RAB9A 2215/4885MEN1 1059/4885

“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.