SCHEMBL19001046

SCHEMBL19001046

Cc1cc(C(C)(C)C)cnc1N1CCN(C(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ TRPV1 Q8NER1 5/20 0.36
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ POLB P06746 2/20 0.33
▸ SLC6A9 P48067 1/20 0.32
▸ SLC6A5 Q9Y345 1/20 0.32
▸ MAPT P10636 3/20 0.32
▸ HPGD P15428 2/20 0.32
▸ HTT P42858 2/20 0.32
▸ HRH4 Q9H3N8 1/20 0.32
▸ HRH3 Q9Y5N1 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL13678371 0.85 MEN1 (0.41) LMNASMN1; SMN2TRPV1MEN1KMT2A
SCHEMBL10203343 0.83 MEN1 (0.38) LMNASMN1; SMN2TRPV1MEN1KMT2A
SCHEMBL14376003 0.81 TP53 (0.42) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL13657963 0.81 ALDH1A1 (0.42) LMNAMEN1KMT2AALDH1A1MAPK1
SCHEMBL12125945 0.77 KDM2B (0.43) LMNASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL17404870 0.76 MEN1 (0.40) LMNASMN1; SMN2MEN1KMT2AHRH4
SCHEMBL10203156 0.75 OPRK1 (0.46) HRH3
SCHEMBL14123275 0.74 KMT2A (0.39) MEN1KMT2AALDH1A1KDM4E
SCHEMBL14123414 0.74 KMT2A (0.39) MEN1KMT2AALDH1A1KDM4E
SCHEMBL14123365 0.74 KMT2A (0.39) MEN1KMT2AALDH1A1KDM4E

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-9938292-B2 Quinoline derivatives as SMO inhibitors GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-04-10 — — US disclosed
US-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-06-22 — — 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-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS SMO, GLI1, SHH LMNA 4670/4885SMN1; SMN2 4029/4885TRPV1 3812/4885

“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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