SCHEMBL17149668

SCHEMBL17149668

O=C(Nc1cccc2[nH]ncc12)c1cc2cc(F)ccc2[nH]1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.67
▸ HTT P42858 2/20 0.67
▸ RAB9A P51151 2/20 0.67
▸ LMNA P02545 1/20 0.67
▸ CYP1A2 P05177 1/20 0.67
▸ CYP3A4 P08684 1/20 0.67
▸ HPGD P15428 1/20 0.67
▸ CYP2C19 P33261 1/20 0.67
▸ DHPS P49366 1/20 0.53
▸ TRPV1 Q8NER1 6/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.49
▸ RXFP1 Q9HBX9 2/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ FLT3 P36888 2/20 0.49
▸ GPER1 Q99527 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47

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
SCHEMBL17149915 0.82 FLT3 (0.58) NPC1RAB9ALMNACYP1A2CYP3A4
SCHEMBL17149778 0.79 CYP1A2 (0.61) CYP1A2CYP3A4MEN1KMT2AALDH1A1
SCHEMBL27336654 0.78 FLT3 (0.58) NPC1RAB9ALMNAHPGDCYP2C19
SCHEMBL17149795 0.78 MEN1 (0.50) NPC1RAB9ALMNAHPGDCYP2C19
SCHEMBL2735816 0.77 FLT3 (0.57) NPC1RAB9ALMNAHPGDCYP2C19
SCHEMBL2735821 0.76 RXFP1 (0.58) NPC1RAB9ALMNAHPGDCYP2C19
SCHEMBL20751659 0.76 HDAC1 (0.69) NPC1RAB9ALMNAHPGDCYP2C19
SCHEMBL20825839 0.76 NR4A1 (0.52) NPC1RAB9ALMNACYP1A2CYP3A4
SCHEMBL22751754 0.76 NPC1 (0.46) NPC1HTTRAB9ALMNACYP1A2
SCHEMBL2735807 0.74 NPC1 (0.62) NPC1RAB9ALMNAHPGDCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10858319-B2 Indole derivatives for use in medicine IOMET PHARMA LTD. (GB) 2020-12-08 — — US disclosed
US-20190084933-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IOMET PHARMA LTD. (GB) 2019-03-21 — — US disclosed
US-10167257-B2 Indole derivatives for use in medicine IOMET PHARMA LTD. (GB) 2019-01-01 — — US disclosed
US-20170107178-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IOMET PHARMA LTD. (GB) 2017-04-20 — — US disclosed
US-20170107178-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IOMET PHARMA LTD. (GB) 2017-04-20 — — US disclosed
WO-2015150097-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IOMET PHARMA LTD (GB) 2015-10-08 — — WO 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 (4 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-10858319-B2 Indole derivatives for use in medicine IDO1, IDO2, TDO2 NPC1 3828/4885HTT 2611/4885RAB9A 4388/4885
US-10167257-B2 Indole derivatives for use in medicine IDO1, IDO2, TDO2 NPC1 3840/4885HTT 2682/4885RAB9A 4322/4885
US-20170107178-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IDO1, IDO2, TDO2 NPC1 3840/4885HTT 2682/4885RAB9A 4322/4885
US-20190084933-A1 INDOLE DERIVATIVES FOR USE IN MEDICINE IDO1, IDO2, TDO2 NPC1 3773/4885HTT 2466/4885RAB9A 4265/4885

“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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